7-bromanyl-4-(3,4-dimethoxyphenyl)carbonyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: 7-bromanyl-4-(3,4-dimethoxyphenyl)carbonyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 7-bromo-4-(3,4-dimethoxybenzoyl)-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 7-bromo-4-[(3,4-dimethoxyphenyl)-oxomethyl]-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 7-bromo-4-(3,4-dimethoxybenzoyl)-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 7-bromo-5-phenyl-4-veratroyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C24H21BrN2O4 MolecularWeight: 481.33854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CC(=O)NC3=C(C2C4=CC=CC=C4)C=C(C=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CC(=O)NC3=C(C2C4=CC=CC=C4)C=C(C=C3)Br)OC

InChI

InChI=1S/C24H21BrN2O4/c1-30-20-11-8-16(12-21(20)31-2)24(29)27-14-22(28)26-19-10-9-17(25)13-18(19)23(27)15-6-4-3-5-7-15/h3-13,23H,14H2,1-2H3,(H,26,28)