1-cyclopropyl-6-fluoranyl-7-[(4-nitrophenyl)sulfonyl-(pyridin-4-ylmethyl)amino]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[(4-nitrophenyl)sulfonyl-(pyridin-4-ylmethyl)amino]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[(4-nitrophenyl)sulfonyl-(4-pyridylmethyl)amino]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[(4-nitrophenyl)sulfonyl-(pyridin-4-ylmethyl)amino]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[(4-nitrophenyl)sulfonyl-(pyridin-4-ylmethyl)amino]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[nosyl(4-pyridylmethyl)amino]quinoline-3-carboxylic acid Formula: C25H19FN4O7S MolecularWeight: 538.504363

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N(CC4=CC=NC=C4)S(=O)(=O)C5=CC=C(C=C5)[N+](=O)[O-])F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N(CC4=CC=NC=C4)S(=O)(=O)C5=CC=C(C=C5)[N+](=O)[O-])F)C(=O)O

InChI

InChI=1S/C25H19FN4O7S/c26-21-11-19-22(28(16-1-2-16)14-20(24(19)31)25(32)33)12-23(21)29(13-15-7-9-27-10-8-15)38(36,37)18-5-3-17(4-6-18)30(34)35/h3-12,14,16H,1-2,13H2,(H,32,33)