4-(7-chloranyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)butanoic acid

Systemtic Name: 4-(7-chloranyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)butanoic acid Openeye Name: 4-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)butanoic acid CAS Name: 4-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)butanoic acid IUPAC Name: 4-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)butanoic acid Traditional Name: 4-(7-chloro-2-keto-5-phenyl-3H-1,4-benzodiazepin-1-yl)butyric acid Formula: C19H17ClN2O3 MolecularWeight: 356.80288

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CCCC(=O)O

Isomeric SMILES

C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CCCC(=O)O

InChI

InChI=1S/C19H17ClN2O3/c20-14-8-9-16-15(11-14)19(13-5-2-1-3-6-13)21-12-17(23)22(16)10-4-7-18(24)25/h1-3,5-6,8-9,11H,4,7,10,12H2,(H,24,25)