4-(4-bromophenyl)carbonyl-3-[(4-methylphenyl)amino]-2H-isoquinolin-1-one

Systemtic Name: 4-(4-bromophenyl)carbonyl-3-[(4-methylphenyl)amino]-2H-isoquinolin-1-one Openeye Name: 4-(4-bromobenzoyl)-3-(4-methylanilino)-2H-isoquinolin-1-one CAS Name: 4-[(4-bromophenyl)-oxomethyl]-3-(4-methylanilino)-2H-isoquinolin-1-one IUPAC Name: 4-(4-bromobenzoyl)-3-(4-methylanilino)-2H-isoquinolin-1-one Traditional Name: 4-(4-bromobenzoyl)-3-(p-toluidino)isocarbostyril Formula: C23H17BrN2O2 MolecularWeight: 433.29728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(C3=CC=CC=C3C(=O)N2)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C3=CC=CC=C3C(=O)N2)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H17BrN2O2/c1-14-6-12-17(13-7-14)25-22-20(21(27)15-8-10-16(24)11-9-15)18-4-2-3-5-19(18)23(28)26-22/h2-13H,1H3,(H2,25,26,28)