6-fluoranyl-4-oxidanylidene-7-[1-(phenylmethoxycarbonylamino)cyclopropyl]-1-(4-phenylmethoxyphenyl)quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-4-oxidanylidene-7-[1-(phenylmethoxycarbonylamino)cyclopropyl]-1-(4-phenylmethoxyphenyl)quinoline-3-carboxylic acid Openeye Name: 7-[1-(benzyloxycarbonylamino)cyclopropyl]-1-(4-benzyloxyphenyl)-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-fluoro-4-oxo-7-[1-(phenylmethoxycarbonylamino)cyclopropyl]-1-(4-phenylmethoxyphenyl)-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-4-oxo-7-[1-(phenylmethoxycarbonylamino)cyclopropyl]-1-(4-phenylmethoxyphenyl)quinoline-3-carboxylic acid Traditional Name: 1-(4-benzoxyphenyl)-7-[1-(benzyloxycarbonylamino)cyclopropyl]-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C34H27FN2O6 MolecularWeight: 578.586383

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)OCC5=CC=CC=C5)F)NC(=O)OCC6=CC=CC=C6

Isomeric SMILES

C1CC1(C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)OCC5=CC=CC=C5)F)NC(=O)OCC6=CC=CC=C6

InChI

InChI=1S/C34H27FN2O6/c35-29-17-26-30(18-28(29)34(15-16-34)36-33(41)43-21-23-9-5-2-6-10-23)37(19-27(31(26)38)32(39)40)24-11-13-25(14-12-24)42-20-22-7-3-1-4-8-22/h1-14,17-19H,15-16,20-21H2,(H,36,41)(H,39,40)