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

Systemtic Name: 1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[4-(2-oxidanylidene-2-phenylazanyl-ethyl)piperazin-1-yl]quinoline-3-carboxylic acid Openeye Name: 7-[4-(2-anilino-2-oxo-ethyl)piperazin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[4-(2-anilino-2-oxoethyl)-1-piperazinyl]-1-cyclopropyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[4-(2-anilino-2-oxoethyl)piperazin-1-yl]-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[4-(2-anilino-2-keto-ethyl)piperazino]-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C25H25FN4O4 MolecularWeight: 464.488803

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)CC(=O)NC5=CC=CC=C5)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)CC(=O)NC5=CC=CC=C5)F)C(=O)O

InChI

InChI=1S/C25H25FN4O4/c26-20-12-18-21(30(17-6-7-17)14-19(24(18)32)25(33)34)13-22(20)29-10-8-28(9-11-29)15-23(31)27-16-4-2-1-3-5-16/h1-5,12-14,17H,6-11,15H2,(H,27,31)(H,33,34)