Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C13H18ClNO.C4H4O4 |
| Molecular Weight | 355.813 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.CC(NC(C)(C)C)C(=O)C1=CC(Cl)=CC=C1
InChI
InChIKey=NJJFBMJGOYCQCX-BTJKTKAUSA-N
InChI=1S/C13H18ClNO.C4H4O4/c1-9(15-13(2,3)4)12(16)10-6-5-7-11(14)8-10;5-3(6)1-2-4(7)8/h5-9,15H,1-4H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
| Molecular Formula | C4H4O4 |
| Molecular Weight | 116.0722 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Optical Activity | NONE |
| Molecular Formula | C13H18ClNO |
| Molecular Weight | 239.741 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 07:32:48 UTC 2023
by
admin
on
Sat Dec 16 07:32:48 UTC 2023
|
| Record UNII |
26NV8NXO4A
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
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Common Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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1013636-49-1
Created by
admin on Sat Dec 16 07:32:48 UTC 2023 , Edited by admin on Sat Dec 16 07:32:48 UTC 2023
|
NON-SPECIFIC STOICHIOMETRY | |||
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93109-98-9
Created by
admin on Sat Dec 16 07:32:48 UTC 2023 , Edited by admin on Sat Dec 16 07:32:48 UTC 2023
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PRIMARY | |||
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26NV8NXO4A
Created by
admin on Sat Dec 16 07:32:48 UTC 2023 , Edited by admin on Sat Dec 16 07:32:48 UTC 2023
|
PRIMARY | |||
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12882211
Created by
admin on Sat Dec 16 07:32:48 UTC 2023 , Edited by admin on Sat Dec 16 07:32:48 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
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PARENT -> SALT/SOLVATE | |||
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|
PARENT -> SALT/SOLVATE |
