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

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[(4-nitrophenyl)sulfonyl-(2-pyrrolidin-1-ylethyl)amino]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[(4-nitrophenyl)sulfonyl-(2-pyrrolidin-1-ylethyl)amino]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[(4-nitrophenyl)sulfonyl-[2-(1-pyrrolidinyl)ethyl]amino]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[(4-nitrophenyl)sulfonyl-(2-pyrrolidin-1-ylethyl)amino]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[nosyl(2-pyrrolidinoethyl)amino]quinoline-3-carboxylic acid Formula: C25H25FN4O7S MolecularWeight: 544.552003

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)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(C1)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/C25H25FN4O7S/c26-21-13-19-22(28(16-3-4-16)15-20(24(19)31)25(32)33)14-23(21)29(12-11-27-9-1-2-10-27)38(36,37)18-7-5-17(6-8-18)30(34)35/h5-8,13-16H,1-4,9-12H2,(H,32,33)