3-[7-(4-chlorophenyl)-6,8-dimethoxy-2-oxidanylidene-7-phenyl-3,8-dihydro-1H-1,4-benzodiazepin-5-yl]benzenecarbonitrile

Systemtic Name: 3-[7-(4-chlorophenyl)-6,8-dimethoxy-2-oxidanylidene-7-phenyl-3,8-dihydro-1H-1,4-benzodiazepin-5-yl]benzenecarbonitrile Openeye Name: 3-[7-(4-chlorophenyl)-6,8-dimethoxy-2-oxo-7-phenyl-3,8-dihydro-1H-1,4-benzodiazepin-5-yl]benzonitrile CAS Name: 3-[7-(4-chlorophenyl)-6,8-dimethoxy-2-oxo-7-phenyl-3,8-dihydro-1H-1,4-benzodiazepin-5-yl]benzonitrile IUPAC Name: 3-[7-(4-chlorophenyl)-6,8-dimethoxy-2-oxo-7-phenyl-3,8-dihydro-1H-1,4-benzodiazepin-5-yl]benzonitrile Traditional Name: 3-[7-(4-chlorophenyl)-2-keto-6,8-dimethoxy-7-phenyl-3,8-dihydro-1H-1,4-benzodiazepin-5-yl]benzonitrile Formula: C30H24ClN3O3 MolecularWeight: 509.98286

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Descriptors Computed from Structure

Canonical SMILES:

COC1C=C2C(=C(C1(C3=CC=CC=C3)C4=CC=C(C=C4)Cl)OC)C(=NCC(=O)N2)C5=CC=CC(=C5)C#N

Isomeric SMILES

COC1C=C2C(=C(C1(C3=CC=CC=C3)C4=CC=C(C=C4)Cl)OC)C(=NCC(=O)N2)C5=CC=CC(=C5)C#N

InChI

InChI=1S/C30H24ClN3O3/c1-36-25-16-24-27(28(33-18-26(35)34-24)20-8-6-7-19(15-20)17-32)29(37-2)30(25,21-9-4-3-5-10-21)22-11-13-23(31)14-12-22/h3-16,25H,18H2,1-2H3,(H,34,35)