1-[6-azanyl-3,5-bis(fluoranyl)pyridin-2-yl]-8-chloranyl-6-fluoranyl-4-oxidanylidene-7-(1-oxidanylpropan-2-ylamino)quinoline-3-carboxylic acid

Systemtic Name: 1-[6-azanyl-3,5-bis(fluoranyl)pyridin-2-yl]-8-chloranyl-6-fluoranyl-4-oxidanylidene-7-(1-oxidanylpropan-2-ylamino)quinoline-3-carboxylic acid Openeye Name: 1-(6-amino-3,5-difluoro-2-pyridyl)-8-chloro-6-fluoro-7-[(2-hydroxy-1-methyl-ethyl)amino]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-(6-amino-3,5-difluoro-2-pyridinyl)-8-chloro-6-fluoro-7-(1-hydroxypropan-2-ylamino)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-(6-amino-3,5-difluoropyridin-2-yl)-8-chloro-6-fluoro-7-(1-hydroxypropan-2-ylamino)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-(6-amino-3,5-difluoro-2-pyridyl)-8-chloro-6-fluoro-7-[(2-hydroxy-1-methyl-ethyl)amino]-4-keto-quinoline-3-carboxylic acid Formula: C18H14ClF3N4O4 MolecularWeight: 442.77637

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CO)NC1=C(C=C2C(=C1Cl)N(C=C(C2=O)C(=O)O)C3=NC(=C(C=C3F)F)N)F

Isomeric SMILES

CC(CO)NC1=C(C=C2C(=C1Cl)N(C=C(C2=O)C(=O)O)C3=NC(=C(C=C3F)F)N)F

InChI

InChI=1S/C18H14ClF3N4O4/c1-6(5-27)24-13-9(20)2-7-14(12(13)19)26(4-8(15(7)28)18(29)30)17-11(22)3-10(21)16(23)25-17/h2-4,6,24,27H,5H2,1H3,(H2,23,25)(H,29,30)