1-(2-chloroethyl)-7-(4-ethanoylpiperazin-1-yl)-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-(2-chloroethyl)-7-(4-ethanoylpiperazin-1-yl)-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(4-acetylpiperazin-1-yl)-1-(2-chloroethyl)-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(4-acetyl-1-piperazinyl)-1-(2-chloroethyl)-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(4-acetylpiperazin-1-yl)-1-(2-chloroethyl)-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(4-acetylpiperazino)-1-(2-chloroethyl)-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C18H19ClFN3O4 MolecularWeight: 395.812563

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)CCCl)F

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)CCCl)F

InChI

InChI=1S/C18H19ClFN3O4/c1-11(24)21-4-6-22(7-5-21)16-9-15-12(8-14(16)20)17(25)13(18(26)27)10-23(15)3-2-19/h8-10H,2-7H2,1H3,(H,26,27)