Details
Stereochemistry | ACHIRAL |
Molecular Formula | C17H14ClO4.C5H14NO |
Molecular Weight | 421.914 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
C[N+](C)(C)CCO.CC(C)(OC1=CC=C(C=C1)C(=O)C2=CC=C(Cl)C=C2)C([O-])=O
InChI
InChIKey=JWAZHODZSADEHB-UHFFFAOYSA-M
InChI=1S/C17H15ClO4.C5H14NO/c1-17(2,16(20)21)22-14-9-5-12(6-10-14)15(19)11-3-7-13(18)8-4-11;1-6(2,3)4-5-7/h3-10H,1-2H3,(H,20,21);7H,4-5H2,1-3H3/q;+1/p-1
Molecular Formula | C17H15ClO4 |
Molecular Weight | 318.752 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C5H13NO |
Molecular Weight | 103.1628 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 16:23:09 UTC 2023
by
admin
on
Sat Dec 16 16:23:09 UTC 2023
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Record UNII |
4BMH7IZT98
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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WHO-VATC |
QC10AB11
Created by
admin on Sat Dec 16 16:23:09 UTC 2023 , Edited by admin on Sat Dec 16 16:23:09 UTC 2023
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WHO-ATC |
C10AB11
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admin on Sat Dec 16 16:23:09 UTC 2023 , Edited by admin on Sat Dec 16 16:23:09 UTC 2023
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NCI_THESAURUS |
C98150
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admin on Sat Dec 16 16:23:09 UTC 2023 , Edited by admin on Sat Dec 16 16:23:09 UTC 2023
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Code System | Code | Type | Description | ||
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DBSALT001885
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8868
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CHEMBL981
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4505
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SUB25725
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4BMH7IZT98
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4BMH7IZT98
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m5279
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admin on Sat Dec 16 16:23:09 UTC 2023 , Edited by admin on Sat Dec 16 16:23:09 UTC 2023
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DTXSID50234939
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856676-23-8
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1133558
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100000090599
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1433887
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admin on Sat Dec 16 16:23:09 UTC 2023 , Edited by admin on Sat Dec 16 16:23:09 UTC 2023
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C75253
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11350701
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SS-76
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admin on Sat Dec 16 16:23:09 UTC 2023 , Edited by admin on Sat Dec 16 16:23:09 UTC 2023
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ACTIVE MOIETY |