3-[(4-bromanyl-3-methyl-phenyl)amino]-2-(2-methylphenyl)-3H-isoindol-1-one

Systemtic Name: 3-[(4-bromanyl-3-methyl-phenyl)amino]-2-(2-methylphenyl)-3H-isoindol-1-one Openeye Name: 3-(4-bromo-3-methyl-anilino)-2-(o-tolyl)isoindolin-1-one CAS Name: 3-(4-bromo-3-methylanilino)-2-(2-methylphenyl)-3H-isoindol-1-one IUPAC Name: 3-(4-bromo-3-methylanilino)-2-(2-methylphenyl)-3H-isoindol-1-one Traditional Name: 3-(4-bromo-3-methyl-anilino)-2-(o-tolyl)isoindolin-1-one Formula: C22H19BrN2O MolecularWeight: 407.30306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(C3=CC=CC=C3C2=O)NC4=CC(=C(C=C4)Br)C

Isomeric SMILES

CC1=CC=CC=C1N2C(C3=CC=CC=C3C2=O)NC4=CC(=C(C=C4)Br)C

InChI

InChI=1S/C22H19BrN2O/c1-14-7-3-6-10-20(14)25-21(17-8-4-5-9-18(17)22(25)26)24-16-11-12-19(23)15(2)13-16/h3-13,21,24H,1-2H3