methyl (2E)-2-[(7-chloranyl-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]-3-pyrrolidin-1-yl-propanoate

Systemtic Name: methyl (2E)-2-[(7-chloranyl-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]-3-pyrrolidin-1-yl-propanoate Openeye Name: methyl (2E)-2-[(7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazono]-3-pyrrolidin-1-yl-propanoate CAS Name: (2E)-2-[(7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]-3-(1-pyrrolidinyl)propanoic acid methyl ester IUPAC Name: methyl (2E)-2-[(7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]-3-pyrrolidin-1-ylpropanoate Traditional Name: (2E)-2-[(7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazono]-3-pyrrolidino-propionic acid methyl ester Formula: C23H24ClN5O2 MolecularWeight: 437.92196

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=NNC1=NC2=C(C=C(C=C2)Cl)C(=NC1)C3=CC=CC=C3)CN4CCCC4

Isomeric SMILES

COC(=O)/C(=N/NC1=NC2=C(C=C(C=C2)Cl)C(=NC1)C3=CC=CC=C3)/CN4CCCC4

InChI

InChI=1S/C23H24ClN5O2/c1-31-23(30)20(15-29-11-5-6-12-29)27-28-21-14-25-22(16-7-3-2-4-8-16)18-13-17(24)9-10-19(18)26-21/h2-4,7-10,13H,5-6,11-12,14-15H2,1H3,(H,26,28)/b27-20+