3-[(4-fluorophenyl)amino]-4-(4-methylphenyl)carbonyl-8aH-isoquinolin-1-one

Systemtic Name: 3-[(4-fluorophenyl)amino]-4-(4-methylphenyl)carbonyl-8aH-isoquinolin-1-one Openeye Name: 3-(4-fluoroanilino)-4-(4-methylbenzoyl)-8aH-isoquinolin-1-one CAS Name: 3-(4-fluoroanilino)-4-[(4-methylphenyl)-oxomethyl]-8aH-isoquinolin-1-one IUPAC Name: 3-(4-fluoroanilino)-4-(4-methylbenzoyl)-8aH-isoquinolin-1-one Traditional Name: 3-(4-fluoroanilino)-4-p-toluoyl-8aH-isoquinolin-1-one Formula: C23H17FN2O2 MolecularWeight: 372.391683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=C3C=CC=CC3C(=O)N=C2NC4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=C3C=CC=CC3C(=O)N=C2NC4=CC=C(C=C4)F

InChI

InChI=1S/C23H17FN2O2/c1-14-6-8-15(9-7-14)21(27)20-18-4-2-3-5-19(18)23(28)26-22(20)25-17-12-10-16(24)11-13-17/h2-13,19H,1H3,(H,25,26,28)