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

Systemtic Name: ethyl (2E)-2-[(7-chloranyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-1-yl)hydrazinylidene]propanoate Openeye Name: ethyl (2E)-2-[(7-chloro-5-phenyl-2,3-dihydro-1,4-benzodiazepin-1-yl)hydrazono]propanoate CAS Name: (2E)-2-[(7-chloro-5-phenyl-2,3-dihydro-1,4-benzodiazepin-1-yl)hydrazinylidene]propanoic acid ethyl ester IUPAC Name: ethyl (2E)-2-[(7-chloro-5-phenyl-2,3-dihydro-1,4-benzodiazepin-1-yl)hydrazinylidene]propanoate Traditional Name: (2E)-2-[(7-chloro-5-phenyl-2,3-dihydro-1,4-benzodiazepin-1-yl)hydrazono]propionic acid ethyl ester Formula: C20H21ClN4O2 MolecularWeight: 384.85934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=NNN1CCN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)/C(=N/NN1CCN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3)/C

InChI

InChI=1S/C20H21ClN4O2/c1-3-27-20(26)14(2)23-24-25-12-11-22-19(15-7-5-4-6-8-15)17-13-16(21)9-10-18(17)25/h4-10,13,24H,3,11-12H2,1-2H3/b23-14+