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Details

Stereochemistry ACHIRAL
Molecular Formula C18H11Cl2N2O3.Na
Molecular Weight 397.187
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of GAVESTINEL SODIUM

SMILES

[Na+].[O-]C(=O)C1=C(\C=C\C(=O)NC2=CC=CC=C2)C3=C(N1)C=C(Cl)C=C3Cl

InChI

InChIKey=GRSDSTMFQHAESM-UHDJGPCESA-M
InChI=1S/C18H12Cl2N2O3.Na/c19-10-8-13(20)16-12(17(18(24)25)22-14(16)9-10)6-7-15(23)21-11-4-2-1-3-5-11;/h1-9,22H,(H,21,23)(H,24,25);/q;+1/p-1/b7-6+;

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C18H11Cl2N2O3
Molecular Weight 374.198
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:42:46 UTC 2023
Edited
by admin
on Fri Dec 15 15:42:46 UTC 2023
Record UNII
80W7787JVB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GAVESTINEL SODIUM
Common Name English
1H-INDOLE-2-CARBOXYLIC ACID, 4,6-DICHLORO-3-((1E)-3-OXO-3-(PHENYLAMINO)-1-PROPENYL)-, MONOSODIUM SALT
Common Name English
1H-INDOLE-2-CARBOXYLIC ACID, 4,6-DICHLORO-3-(3-OXO-3-(PHENYLAMINO)-1-PROPENYL)-, MONOSODIUM SALT, (E)-
Common Name English
4,6-DICHLORO-3-((1E)-3-OXO-3-(PHENYLAMINO)-1-PROPENYL)-1H-INDOLE-2-CARBOXYLIC ACID SODIUM SALT
Common Name English
GV-150526A
Code English
1H-INDOLE-2-CARBOXYLIC ACID, 4,6-DICHLORO-3-((1E)-3-OXO-3-(PHENYLAMINO)-1-PROPEN-1-YL)-, SODIUM SALT (1:1)
Common Name English
Code System Code Type Description
FDA UNII
80W7787JVB
Created by admin on Fri Dec 15 15:42:46 UTC 2023 , Edited by admin on Fri Dec 15 15:42:46 UTC 2023
PRIMARY
MESH
C105319
Created by admin on Fri Dec 15 15:42:46 UTC 2023 , Edited by admin on Fri Dec 15 15:42:46 UTC 2023
PRIMARY
EPA CompTox
DTXSID20165327
Created by admin on Fri Dec 15 15:42:46 UTC 2023 , Edited by admin on Fri Dec 15 15:42:46 UTC 2023
PRIMARY
CAS
153436-38-5
Created by admin on Fri Dec 15 15:42:46 UTC 2023 , Edited by admin on Fri Dec 15 15:42:46 UTC 2023
PRIMARY
DRUG BANK
DBSALT002362
Created by admin on Fri Dec 15 15:42:46 UTC 2023 , Edited by admin on Fri Dec 15 15:42:46 UTC 2023
PRIMARY
PUBCHEM
16759177
Created by admin on Fri Dec 15 15:42:46 UTC 2023 , Edited by admin on Fri Dec 15 15:42:46 UTC 2023
PRIMARY
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ACTIVE MOIETY