7-(azepan-1-yl)-6-fluoranyl-1-methyl-3-(phenylsulfonyl)quinolin-4-one

Systemtic Name: 7-(azepan-1-yl)-6-fluoranyl-1-methyl-3-(phenylsulfonyl)quinolin-4-one Openeye Name: 7-(azepan-1-yl)-3-(benzenesulfonyl)-6-fluoro-1-methyl-quinolin-4-one CAS Name: 7-(1-azepanyl)-3-(benzenesulfonyl)-6-fluoro-1-methyl-4-quinolinone IUPAC Name: 7-(azepan-1-yl)-3-(benzenesulfonyl)-6-fluoro-1-methylquinolin-4-one Traditional Name: 7-(azepan-1-yl)-3-besyl-6-fluoro-1-methyl-4-quinolone Formula: C22H23FN2O3S MolecularWeight: 414.493023

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=CC(=C(C=C21)N3CCCCCC3)F)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CN1C=C(C(=O)C2=CC(=C(C=C21)N3CCCCCC3)F)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H23FN2O3S/c1-24-15-21(29(27,28)16-9-5-4-6-10-16)22(26)17-13-18(23)20(14-19(17)24)25-11-7-2-3-8-12-25/h4-6,9-10,13-15H,2-3,7-8,11-12H2,1H3