1-[4-[(4-fluoranyl-2-methyl-phenyl)amino]-8-methoxy-6-oxidanyl-quinolin-3-yl]butan-1-one

Systemtic Name: 1-[4-[(4-fluoranyl-2-methyl-phenyl)amino]-8-methoxy-6-oxidanyl-quinolin-3-yl]butan-1-one Openeye Name: 1-[4-(4-fluoro-2-methyl-anilino)-6-hydroxy-8-methoxy-3-quinolyl]butan-1-one CAS Name: 1-[4-(4-fluoro-2-methylanilino)-6-hydroxy-8-methoxy-3-quinolinyl]-1-butanone IUPAC Name: 1-[4-(4-fluoro-2-methylanilino)-6-hydroxy-8-methoxyquinolin-3-yl]butan-1-one Traditional Name: 1-[4-(4-fluoro-2-methyl-anilino)-6-hydroxy-8-methoxy-3-quinolyl]butan-1-one Formula: C21H21FN2O3 MolecularWeight: 368.401443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=C(C2=CC(=CC(=C2N=C1)OC)O)NC3=C(C=C(C=C3)F)C

Isomeric SMILES

CCCC(=O)C1=C(C2=CC(=CC(=C2N=C1)OC)O)NC3=C(C=C(C=C3)F)C

InChI

InChI=1S/C21H21FN2O3/c1-4-5-18(26)16-11-23-21-15(9-14(25)10-19(21)27-3)20(16)24-17-7-6-13(22)8-12(17)2/h6-11,25H,4-5H2,1-3H3,(H,23,24)