8-chloranyl-6-fluoranyl-1-(1-methylcyclopropyl)-7-(3-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 8-chloranyl-6-fluoranyl-1-(1-methylcyclopropyl)-7-(3-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 8-chloro-6-fluoro-1-(1-methylcyclopropyl)-7-(3-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 8-chloro-6-fluoro-1-(1-methylcyclopropyl)-7-(3-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 8-chloro-6-fluoro-1-(1-methylcyclopropyl)-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 8-chloro-6-fluoro-4-keto-1-(1-methylcyclopropyl)-7-(3-methylpiperazino)quinoline-3-carboxylic acid Formula: C19H21ClFN3O3 MolecularWeight: 393.839743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C4(CC4)C)F

Isomeric SMILES

CC1CN(CCN1)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C4(CC4)C)F

InChI

InChI=1S/C19H21ClFN3O3/c1-10-8-23(6-5-22-10)16-13(21)7-11-15(14(16)20)24(19(2)3-4-19)9-12(17(11)25)18(26)27/h7,9-10,22H,3-6,8H2,1-2H3,(H,26,27)