7-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-1-ethyl-6-fluoranyl-3-(4-methoxyphenyl)sulfonyl-quinolin-4-one

Systemtic Name: 7-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-1-ethyl-6-fluoranyl-3-(4-methoxyphenyl)sulfonyl-quinolin-4-one Openeye Name: 7-[(3R,5R)-3,5-dimethyl-1-piperidyl]-1-ethyl-6-fluoro-3-(4-methoxyphenyl)sulfonyl-quinolin-4-one CAS Name: 7-[(3R,5R)-3,5-dimethyl-1-piperidinyl]-1-ethyl-6-fluoro-3-(4-methoxyphenyl)sulfonyl-4-quinolinone IUPAC Name: 7-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-1-ethyl-6-fluoro-3-(4-methoxyphenyl)sulfonylquinolin-4-one Traditional Name: 7-[(3R,5R)-3,5-dimethylpiperidino]-1-ethyl-6-fluoro-3-(4-methoxyphenyl)sulfonyl-4-quinolone Formula: C25H29FN2O4S MolecularWeight: 472.572163

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CC(CC(C3)C)C)F)S(=O)(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3C[C@@H](C[C@H](C3)C)C)F)S(=O)(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H29FN2O4S/c1-5-27-15-24(33(30,31)19-8-6-18(32-4)7-9-19)25(29)20-11-21(26)23(12-22(20)27)28-13-16(2)10-17(3)14-28/h6-9,11-12,15-17H,5,10,13-14H2,1-4H3/t16-,17-/m1/s1