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

Systemtic Name: 7-bromanyl-4-(2-methylphenyl)carbonyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 7-bromo-4-(2-methylbenzoyl)-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 7-bromo-4-[(2-methylphenyl)-oxomethyl]-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 7-bromo-4-(2-methylbenzoyl)-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 7-bromo-4-o-toluoyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C23H19BrN2O2 MolecularWeight: 435.31316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CC(=O)NC3=C(C2C4=CC=CC=C4)C=C(C=C3)Br

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CC(=O)NC3=C(C2C4=CC=CC=C4)C=C(C=C3)Br

InChI

InChI=1S/C23H19BrN2O2/c1-15-7-5-6-10-18(15)23(28)26-14-21(27)25-20-12-11-17(24)13-19(20)22(26)16-8-3-2-4-9-16/h2-13,22H,14H2,1H3,(H,25,27)