1-cyclopropyl-6,8-bis(fluoranyl)-7-(4-methanoyl-3-phenyl-piperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6,8-bis(fluoranyl)-7-(4-methanoyl-3-phenyl-piperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6,8-difluoro-7-(4-formyl-3-phenyl-piperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6,8-difluoro-7-(4-formyl-3-phenyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6,8-difluoro-7-(4-formyl-3-phenylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6,8-difluoro-7-(4-formyl-3-phenyl-piperazino)-4-keto-quinoline-3-carboxylic acid Formula: C24H21F2N3O4 MolecularWeight: 453.438046

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C(=C32)F)N4CCN(C(C4)C5=CC=CC=C5)C=O)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C(=C32)F)N4CCN(C(C4)C5=CC=CC=C5)C=O)F)C(=O)O

InChI

InChI=1S/C24H21F2N3O4/c25-18-10-16-21(29(15-6-7-15)11-17(23(16)31)24(32)33)20(26)22(18)27-8-9-28(13-30)19(12-27)14-4-2-1-3-5-14/h1-5,10-11,13,15,19H,6-9,12H2,(H,32,33)