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Details

Stereochemistry ACHIRAL
Molecular Formula C18H13FN2O3
Molecular Weight 324.3058
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENZOIC ACID, 4-(8-FLUORO-3,4,5,6-TETRAHYDRO-6-OXO-1H-PYRROLO(4,3,2-EF)(2)BENZAZEPIN-2-YL)-

SMILES

OC(=O)C1=CC=C(C=C1)C2=C3CCNC(=O)C4=CC(F)=CC(N2)=C34

InChI

InChIKey=KNTCUVWNFYUDDX-UHFFFAOYSA-N
InChI=1S/C18H13FN2O3/c19-11-7-13-15-12(5-6-20-17(13)22)16(21-14(15)8-11)9-1-3-10(4-2-9)18(23)24/h1-4,7-8,21H,5-6H2,(H,20,22)(H,23,24)

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
BENZOIC ACID, 4-(8-FLUORO-3,4,5,6-TETRAHYDRO-6-OXO-1H-PYRROLO(4,3,2-EF)(2)BENZAZEPIN-2-YL)-
Systematic Name English
RUCAPARIB METABOLITE M324
Common Name English
Code System Code Type Description
PUBCHEM
154409547
Created by admin on Sat Dec 16 14:35:08 GMT 2023 , Edited by admin on Sat Dec 16 14:35:08 GMT 2023
PRIMARY
CAS
1577998-89-0
Created by admin on Sat Dec 16 14:35:08 GMT 2023 , Edited by admin on Sat Dec 16 14:35:08 GMT 2023
PRIMARY
FDA UNII
V2GJ2XVK6G
Created by admin on Sat Dec 16 14:35:08 GMT 2023 , Edited by admin on Sat Dec 16 14:35:08 GMT 2023
PRIMARY
PARENT (METABOLITE)
Structure of RUCAPARIB
NIH
NCATS
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