1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[4-[(8-oxidanylquinolin-2-yl)methyl]piperazin-1-yl]quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[4-[(8-oxidanylquinolin-2-yl)methyl]piperazin-1-yl]quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[4-[(8-hydroxy-2-quinolyl)methyl]piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[4-[(8-hydroxy-2-quinolinyl)methyl]-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[4-[(8-hydroxyquinolin-2-yl)methyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-7-[4-[(8-hydroxy-2-quinolyl)methyl]piperazino]-4-keto-quinoline-3-carboxylic acid Formula: C27H25FN4O4 MolecularWeight: 488.510203

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)CC5=NC6=C(C=CC=C6O)C=C5)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)CC5=NC6=C(C=CC=C6O)C=C5)F)C(=O)O

InChI

InChI=1S/C27H25FN4O4/c28-21-12-19-22(32(18-6-7-18)15-20(26(19)34)27(35)36)13-23(21)31-10-8-30(9-11-31)14-17-5-4-16-2-1-3-24(33)25(16)29-17/h1-5,12-13,15,18,33H,6-11,14H2,(H,35,36)