1-cyclopropyl-6-fluoranyl-7-[(4-nitrophenyl)sulfonyl-(2-piperidin-1-ylethyl)amino]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[(4-nitrophenyl)sulfonyl-(2-piperidin-1-ylethyl)amino]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[(4-nitrophenyl)sulfonyl-[2-(1-piperidyl)ethyl]amino]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[(4-nitrophenyl)sulfonyl-[2-(1-piperidinyl)ethyl]amino]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[(4-nitrophenyl)sulfonyl-(2-piperidin-1-ylethyl)amino]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[nosyl(2-piperidinoethyl)amino]quinoline-3-carboxylic acid Formula: C26H27FN4O7S MolecularWeight: 558.578583

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCN(C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)S(=O)(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CCN(C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)S(=O)(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H27FN4O7S/c27-22-14-20-23(29(17-4-5-17)16-21(25(20)32)26(33)34)15-24(22)30(13-12-28-10-2-1-3-11-28)39(37,38)19-8-6-18(7-9-19)31(35)36/h6-9,14-17H,1-5,10-13H2,(H,33,34)