3-[(6-fluoranyl-2-methyl-3,4-dihydro-2H-quinolin-1-yl)carbonyl]-4-(4-methylphenyl)isochromen-1-one

Systemtic Name: 3-[(6-fluoranyl-2-methyl-3,4-dihydro-2H-quinolin-1-yl)carbonyl]-4-(4-methylphenyl)isochromen-1-one Openeye Name: 3-(6-fluoro-2-methyl-3,4-dihydro-2H-quinoline-1-carbonyl)-4-(p-tolyl)isochromen-1-one CAS Name: 3-[(6-fluoro-2-methyl-3,4-dihydro-2H-quinolin-1-yl)-oxomethyl]-4-(4-methylphenyl)-2-benzopyran-1-one IUPAC Name: 3-(6-fluoro-2-methyl-3,4-dihydro-2H-quinoline-1-carbonyl)-4-(4-methylphenyl)isochromen-1-one Traditional Name: 3-(6-fluoro-2-methyl-3,4-dihydro-2H-quinoline-1-carbonyl)-4-(p-tolyl)isocoumarin Formula: C27H22FNO3 MolecularWeight: 427.466883

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(N1C(=O)C3=C(C4=CC=CC=C4C(=O)O3)C5=CC=C(C=C5)C)C=CC(=C2)F

Isomeric SMILES

CC1CCC2=C(N1C(=O)C3=C(C4=CC=CC=C4C(=O)O3)C5=CC=C(C=C5)C)C=CC(=C2)F

InChI

InChI=1S/C27H22FNO3/c1-16-7-10-18(11-8-16)24-21-5-3-4-6-22(21)27(31)32-25(24)26(30)29-17(2)9-12-19-15-20(28)13-14-23(19)29/h3-8,10-11,13-15,17H,9,12H2,1-2H3