Details
Stereochemistry | ACHIRAL |
Molecular Formula | 2C17H18FN3O3.2ClH.3H2O |
Molecular Weight | 789.651 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.O.Cl.Cl.OC(=O)C1=CN(C2CC2)C3=CC(N4CCNCC4)=C(F)C=C3C1=O.OC(=O)C5=CN(C6CC6)C7=CC(N8CCNCC8)=C(F)C=C7C5=O
InChI
InChIKey=SMFVXHJJUFAKBS-UHFFFAOYSA-N
InChI=1S/2C17H18FN3O3.2ClH.3H2O/c2*18-13-7-11-14(8-15(13)20-5-3-19-4-6-20)21(10-1-2-10)9-12(16(11)22)17(23)24;;;;;/h2*7-10,19H,1-6H2,(H,23,24);2*1H;3*1H2
Molecular Formula | H2O |
Molecular Weight | 18.0153 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C17H18FN3O3 |
Molecular Weight | 331.3415 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | ClH |
Molecular Weight | 36.461 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
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 02:12:03 UTC 2023
by
admin
on
Sat Dec 16 02:12:03 UTC 2023
|
Record UNII |
G43NV09DD4
|
Record Status |
Validated (UNII)
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Record Version |
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-
Download
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Common Name | English |
Code System | Code | Type | Description | ||
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76961290
Created by
admin on Sat Dec 16 02:12:03 UTC 2023 , Edited by admin on Sat Dec 16 02:12:03 UTC 2023
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PRIMARY | |||
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G43NV09DD4
Created by
admin on Sat Dec 16 02:12:03 UTC 2023 , Edited by admin on Sat Dec 16 02:12:03 UTC 2023
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PRIMARY |
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PARENT -> SALT/SOLVATE | |||
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ANHYDROUS->SOLVATE |
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ACTIVE MOIETY |