4-[2-(3,4-dimethoxyphenyl)ethanoyl]-7-methyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: 4-[2-(3,4-dimethoxyphenyl)ethanoyl]-7-methyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 4-[2-(3,4-dimethoxyphenyl)acetyl]-7-methyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 4-[2-(3,4-dimethoxyphenyl)-1-oxoethyl]-7-methyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 4-[2-(3,4-dimethoxyphenyl)acetyl]-7-methyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 4-homoveratroyl-7-methyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C26H26N2O4 MolecularWeight: 430.49564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)CN(C2C3=CC=CC=C3)C(=O)CC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)CN(C2C3=CC=CC=C3)C(=O)CC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C26H26N2O4/c1-17-9-11-21-20(13-17)26(19-7-5-4-6-8-19)28(16-24(29)27-21)25(30)15-18-10-12-22(31-2)23(14-18)32-3/h4-14,26H,15-16H2,1-3H3,(H,27,29)