ethyl 8-[bis(fluoranyl)methoxy]-1-cyclopropyl-7-[7-methoxy-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindol-5-yl]-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 8-[bis(fluoranyl)methoxy]-1-cyclopropyl-7-[7-methoxy-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindol-5-yl]-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-cyclopropyl-8-(difluoromethoxy)-7-[7-methoxy-2-(p-tolylsulfonyl)isoindolin-5-yl]-4-oxo-quinoline-3-carboxylate CAS Name: 1-cyclopropyl-8-(difluoromethoxy)-7-[7-methoxy-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindol-5-yl]-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-cyclopropyl-8-(difluoromethoxy)-7-[7-methoxy-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindol-5-yl]-4-oxoquinoline-3-carboxylate Traditional Name: 1-cyclopropyl-8-(difluoromethoxy)-4-keto-7-(7-methoxy-2-tosyl-isoindolin-5-yl)quinoline-3-carboxylic acid ethyl ester Formula: C32H30F2N2O7S MolecularWeight: 624.651606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C1=O)C=CC(=C2OC(F)F)C3=CC4=C(CN(C4)S(=O)(=O)C5=CC=C(C=C5)C)C(=C3)OC)C6CC6

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C1=O)C=CC(=C2OC(F)F)C3=CC4=C(CN(C4)S(=O)(=O)C5=CC=C(C=C5)C)C(=C3)OC)C6CC6

InChI

InChI=1S/C32H30F2N2O7S/c1-4-42-31(38)26-17-36(21-7-8-21)28-24(29(26)37)12-11-23(30(28)43-32(33)34)19-13-20-15-35(16-25(20)27(14-19)41-3)44(39,40)22-9-5-18(2)6-10-22/h5-6,9-14,17,21,32H,4,7-8,15-16H2,1-3H3