diethyl (2Z)-2-[(7-chloranyl-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]butanedioate

Systemtic Name: diethyl (2Z)-2-[(7-chloranyl-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]butanedioate Openeye Name: diethyl (2Z)-2-[(7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazono]butanedioate CAS Name: (2Z)-2-[(7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]butanedioic acid diethyl ester IUPAC Name: diethyl (2Z)-2-[(7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]butanedioate Traditional Name: (2Z)-2-[(7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazono]succinic acid diethyl ester Formula: C23H23ClN4O4 MolecularWeight: 454.90612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=NNC1=NC2=C(C=C(C=C2)Cl)C(=NC1)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C/C(=N/NC1=NC2=C(C=C(C=C2)Cl)C(=NC1)C3=CC=CC=C3)/C(=O)OCC

InChI

InChI=1S/C23H23ClN4O4/c1-3-31-21(29)13-19(23(30)32-4-2)27-28-20-14-25-22(15-8-6-5-7-9-15)17-12-16(24)10-11-18(17)26-20/h5-12H,3-4,13-14H2,1-2H3,(H,26,28)/b27-19-