1-cyclopropyl-6,8-bis(fluoranyl)-5-(methylamino)-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6,8-bis(fluoranyl)-5-(methylamino)-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6,8-difluoro-5-(methylamino)-7-(4-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6,8-difluoro-5-(methylamino)-7-(4-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6,8-difluoro-5-(methylamino)-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6,8-difluoro-4-keto-5-(methylamino)-7-(4-methylpiperazino)quinoline-3-carboxylic acid Formula: C19H22F2N4O3 MolecularWeight: 392.399786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C(=C(C2=C1C(=O)C(=CN2C3CC3)C(=O)O)F)N4CCN(CC4)C)F

Isomeric SMILES

CNC1=C(C(=C(C2=C1C(=O)C(=CN2C3CC3)C(=O)O)F)N4CCN(CC4)C)F

InChI

InChI=1S/C19H22F2N4O3/c1-22-15-12-16(25(10-3-4-10)9-11(18(12)26)19(27)28)14(21)17(13(15)20)24-7-5-23(2)6-8-24/h9-10,22H,3-8H2,1-2H3,(H,27,28)