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

Systemtic Name: methyl (2Z)-2-[(7-chloranyl-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]butanoate Openeye Name: methyl (2Z)-2-[(7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazono]butanoate CAS Name: (2Z)-2-[(7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]butanoic acid methyl ester IUPAC Name: methyl (2Z)-2-[(7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]butanoate Traditional Name: (2Z)-2-[(7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazono]butyric acid methyl ester Formula: C20H19ClN4O2 MolecularWeight: 382.84346

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC1=NC2=C(C=C(C=C2)Cl)C(=NC1)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C20H19ClN4O2/c1-3-16(20(26)27-2)24-25-18-12-22-19(13-7-5-4-6-8-13)15-11-14(21)9-10-17(15)23-18/h4-11H,3,12H2,1-2H3,(H,23,25)/b24-16-