1-ethyl-6-fluoranyl-4-oxidanylidene-7-[[1-(phenylmethyl)piperidin-4-yl]amino]quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6-fluoranyl-4-oxidanylidene-7-[[1-(phenylmethyl)piperidin-4-yl]amino]quinoline-3-carboxylic acid Openeye Name: 7-[(1-benzyl-4-piperidyl)amino]-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6-fluoro-4-oxo-7-[[1-(phenylmethyl)-4-piperidinyl]amino]-3-quinolinecarboxylic acid IUPAC Name: 7-[(1-benzylpiperidin-4-yl)amino]-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[(1-benzyl-4-piperidyl)amino]-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C24H26FN3O3 MolecularWeight: 423.479943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)NC3CCN(CC3)CC4=CC=CC=C4)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)NC3CCN(CC3)CC4=CC=CC=C4)F)C(=O)O

InChI

InChI=1S/C24H26FN3O3/c1-2-28-15-19(24(30)31)23(29)18-12-20(25)21(13-22(18)28)26-17-8-10-27(11-9-17)14-16-6-4-3-5-7-16/h3-7,12-13,15,17,26H,2,8-11,14H2,1H3,(H,30,31)