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

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[1-methoxypropan-2-yl-(4-nitrophenyl)sulfonyl-amino]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[(2-methoxy-1-methyl-ethyl)-(4-nitrophenyl)sulfonyl-amino]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[1-methoxypropan-2-yl-(4-nitrophenyl)sulfonylamino]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[1-methoxypropan-2-yl-(4-nitrophenyl)sulfonylamino]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[(2-methoxy-1-methyl-ethyl)-nosyl-amino]quinoline-3-carboxylic acid Formula: C23H22FN3O8S MolecularWeight: 519.499483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(COC)N(C1=C(C=C2C(=C1)N(C=C(C2=O)C(=O)O)C3CC3)F)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(COC)N(C1=C(C=C2C(=C1)N(C=C(C2=O)C(=O)O)C3CC3)F)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H22FN3O8S/c1-13(12-35-2)26(36(33,34)16-7-5-15(6-8-16)27(31)32)21-10-20-17(9-19(21)24)22(28)18(23(29)30)11-25(20)14-3-4-14/h5-11,13-14H,3-4,12H2,1-2H3,(H,29,30)