[8-[(Z)-1-chloranylprop-1-enyl]-1-cyclopropyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinolin-3-yl] hydrogen carbonate hydrochloride

Systemtic Name: [8-[(Z)-1-chloranylprop-1-enyl]-1-cyclopropyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinolin-3-yl] hydrogen carbonate hydrochloride Openeye Name: [8-[(Z)-1-chloroprop-1-enyl]-1-cyclopropyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-3-quinolyl] hydrogen carbonate hydrochloride CAS Name: carbonic acid [8-[(Z)-1-chloroprop-1-enyl]-1-cyclopropyl-6-fluoro-7-(4-methyl-1-piperazinyl)-4-oxo-3-quinolinyl] ester hydrochloride IUPAC Name: [8-[(Z)-1-chloroprop-1-enyl]-1-cyclopropyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxoquinolin-3-yl] hydrogen carbonate hydrochloride Traditional Name: carbonic acid [8-[(Z)-1-chloroprop-1-enyl]-1-cyclopropyl-6-fluoro-4-keto-7-(4-methylpiperazino)-3-quinolyl] ester hydrochloride Formula: C21H24Cl2FN3O4 MolecularWeight: 472.337363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=C(C1=C2C(=CC(=C1N3CCN(CC3)C)F)C(=O)C(=CN2C4CC4)OC(=O)O)Cl.Cl

Isomeric SMILES

C/C=C(/C1=C2C(=CC(=C1N3CCN(CC3)C)F)C(=O)C(=CN2C4CC4)OC(=O)O)\Cl.Cl

InChI

InChI=1S/C21H23ClFN3O4.ClH/c1-3-14(22)17-18-13(10-15(23)19(17)25-8-6-24(2)7-9-25)20(27)16(30-21(28)29)11-26(18)12-4-5-12;/h3,10-12H,4-9H2,1-2H3,(H,28,29);1H/b14-3-;