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

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[4-[(2E)-2-methoxyimino-2-thiophen-2-yl-ethyl]piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[4-[(2E)-2-methoxyimino-2-(2-thienyl)ethyl]piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[4-[(2E)-2-methoxyimino-2-thiophen-2-ylethyl]-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[4-[(2E)-2-methoxyimino-2-thiophen-2-ylethyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[4-[(2E)-2-methyloximino-2-(2-thienyl)ethyl]piperazino]quinoline-3-carboxylic acid Formula: C24H25FN4O4S MolecularWeight: 484.543103

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Descriptors Computed from Structure

Canonical SMILES:

CON=C(CN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)C5=CC=CS5

Isomeric SMILES

CO/N=C(\CN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)/C5=CC=CS5

InChI

InChI=1S/C24H25FN4O4S/c1-33-26-19(22-3-2-10-34-22)14-27-6-8-28(9-7-27)21-12-20-16(11-18(21)25)23(30)17(24(31)32)13-29(20)15-4-5-15/h2-3,10-13,15H,4-9,14H2,1H3,(H,31,32)/b26-19+