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

Systemtic Name: ethyl (2E)-2-[(7-chloranyl-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]propanoate Openeye Name: ethyl (2E)-2-[(7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazono]propanoate CAS Name: (2E)-2-[(7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]propanoic acid ethyl ester IUPAC Name: ethyl (2E)-2-[(7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]propanoate Traditional Name: (2E)-2-[(7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazono]propionic acid ethyl ester Formula: C20H19ClN4O2 MolecularWeight: 382.84346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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