1-[8-fluoranyl-4-[(2-methyl-4-oxidanyl-phenyl)amino]quinolin-3-yl]butan-1-one

Systemtic Name: 1-[8-fluoranyl-4-[(2-methyl-4-oxidanyl-phenyl)amino]quinolin-3-yl]butan-1-one Openeye Name: 1-[8-fluoro-4-(4-hydroxy-2-methyl-anilino)-3-quinolyl]butan-1-one CAS Name: 1-[8-fluoro-4-(4-hydroxy-2-methylanilino)-3-quinolinyl]-1-butanone IUPAC Name: 1-[8-fluoro-4-(4-hydroxy-2-methylanilino)quinolin-3-yl]butan-1-one Traditional Name: 1-[8-fluoro-4-(4-hydroxy-2-methyl-anilino)-3-quinolyl]butan-1-one Formula: C20H19FN2O2 MolecularWeight: 338.375463

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CN=C2C(=C1NC3=C(C=C(C=C3)O)C)C=CC=C2F

Isomeric SMILES

CCCC(=O)C1=CN=C2C(=C1NC3=C(C=C(C=C3)O)C)C=CC=C2F

InChI

InChI=1S/C20H19FN2O2/c1-3-5-18(25)15-11-22-20-14(6-4-7-16(20)21)19(15)23-17-9-8-13(24)10-12(17)2/h4,6-11,24H,3,5H2,1-2H3,(H,22,23)