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

Systemtic Name: ethyl 6-fluoranyl-1-(4-methoxy-2-methyl-phenyl)-4-oxidanylidene-7-[1-(phenylmethoxycarbonylamino)cyclopropyl]quinoline-3-carboxylate Openeye Name: ethyl 7-[1-(benzyloxycarbonylamino)cyclopropyl]-6-fluoro-1-(4-methoxy-2-methyl-phenyl)-4-oxo-quinoline-3-carboxylate CAS Name: 6-fluoro-1-(4-methoxy-2-methylphenyl)-4-oxo-7-[1-(phenylmethoxycarbonylamino)cyclopropyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-fluoro-1-(4-methoxy-2-methylphenyl)-4-oxo-7-[1-(phenylmethoxycarbonylamino)cyclopropyl]quinoline-3-carboxylate Traditional Name: 7-[1-(benzyloxycarbonylamino)cyclopropyl]-6-fluoro-4-keto-1-(4-methoxy-2-methyl-phenyl)quinoline-3-carboxylic acid ethyl ester Formula: C31H29FN2O6 MolecularWeight: 544.570163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)C3(CC3)NC(=O)OCC4=CC=CC=C4)C5=C(C=C(C=C5)OC)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)C3(CC3)NC(=O)OCC4=CC=CC=C4)C5=C(C=C(C=C5)OC)C

InChI

InChI=1S/C31H29FN2O6/c1-4-39-29(36)23-17-34(26-11-10-21(38-3)14-19(26)2)27-16-24(25(32)15-22(27)28(23)35)31(12-13-31)33-30(37)40-18-20-8-6-5-7-9-20/h5-11,14-17H,4,12-13,18H2,1-3H3,(H,33,37)