1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[4-(2-oxidanylidene-2-thiophen-2-yl-ethyl)piperazin-1-yl]quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[4-(2-oxidanylidene-2-thiophen-2-yl-ethyl)piperazin-1-yl]quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[4-[2-oxo-2-(2-thienyl)ethyl]piperazin-1-yl]quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[4-(2-oxo-2-thiophen-2-ylethyl)-1-piperazinyl]-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[4-(2-oxo-2-thiophen-2-ylethyl)piperazin-1-yl]quinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[4-[2-keto-2-(2-thienyl)ethyl]piperazino]quinoline-3-carboxylic acid Formula: C23H22FN3O4S MolecularWeight: 455.501883

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)CC(=O)C5=CC=CS5)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)CC(=O)C5=CC=CS5)F)C(=O)O

InChI

InChI=1S/C23H22FN3O4S/c24-17-10-15-18(27(14-3-4-14)12-16(22(15)29)23(30)31)11-19(17)26-7-5-25(6-8-26)13-20(28)21-2-1-9-32-21/h1-2,9-12,14H,3-8,13H2,(H,30,31)