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

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[4-[(2E)-2-hydroxyimino-2-(4-methylphenyl)ethyl]piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[4-[(2E)-2-hydroxyimino-2-(p-tolyl)ethyl]piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[4-[(2E)-2-hydroxyimino-2-(4-methylphenyl)ethyl]-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[4-[(2E)-2-hydroxyimino-2-(4-methylphenyl)ethyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-7-[4-[(2E)-2-hydroximino-2-(p-tolyl)ethyl]piperazino]-4-keto-quinoline-3-carboxylic acid Formula: C26H27FN4O4 MolecularWeight: 478.515383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=NO)CN2CCN(CC2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5CC5)F

Isomeric SMILES

CC1=CC=C(C=C1)/C(=N\O)/CN2CCN(CC2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5CC5)F

InChI

InChI=1S/C26H27FN4O4/c1-16-2-4-17(5-3-16)22(28-35)15-29-8-10-30(11-9-29)24-13-23-19(12-21(24)27)25(32)20(26(33)34)14-31(23)18-6-7-18/h2-5,12-14,18,35H,6-11,15H2,1H3,(H,33,34)/b28-22-