6-fluoranyl-1-(4-methoxy-2-methyl-phenyl)-4-oxidanylidene-7-[1-(phenylmethoxycarbonylamino)cyclopropyl]quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-1-(4-methoxy-2-methyl-phenyl)-4-oxidanylidene-7-[1-(phenylmethoxycarbonylamino)cyclopropyl]quinoline-3-carboxylic acid Openeye Name: 7-[1-(benzyloxycarbonylamino)cyclopropyl]-6-fluoro-1-(4-methoxy-2-methyl-phenyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-fluoro-1-(4-methoxy-2-methylphenyl)-4-oxo-7-[1-(phenylmethoxycarbonylamino)cyclopropyl]-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-1-(4-methoxy-2-methylphenyl)-4-oxo-7-[1-(phenylmethoxycarbonylamino)cyclopropyl]quinoline-3-carboxylic acid Traditional Name: 7-[1-(benzyloxycarbonylamino)cyclopropyl]-6-fluoro-4-keto-1-(4-methoxy-2-methyl-phenyl)quinoline-3-carboxylic acid Formula: C29H25FN2O6 MolecularWeight: 516.517003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)N2C=C(C(=O)C3=CC(=C(C=C32)C4(CC4)NC(=O)OCC5=CC=CC=C5)F)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)OC)N2C=C(C(=O)C3=CC(=C(C=C32)C4(CC4)NC(=O)OCC5=CC=CC=C5)F)C(=O)O

InChI

InChI=1S/C29H25FN2O6/c1-17-12-19(37-2)8-9-24(17)32-15-21(27(34)35)26(33)20-13-23(30)22(14-25(20)32)29(10-11-29)31-28(36)38-16-18-6-4-3-5-7-18/h3-9,12-15H,10-11,16H2,1-2H3,(H,31,36)(H,34,35)