methyl 1-[4-[[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]phenyl]sulfonylpyrrolidine-2-carboxylate

Systemtic Name: methyl 1-[4-[[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]phenyl]sulfonylpyrrolidine-2-carboxylate Openeye Name: methyl 1-[4-[[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]phenyl]sulfonylpyrrolidine-2-carboxylate CAS Name: 1-[4-[[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]phenyl]sulfonyl-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-[[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]phenyl]sulfonylpyrrolidine-2-carboxylate Traditional Name: 1-[4-[[2-keto-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]phenyl]sulfonylpyrrolidine-2-carboxylic acid methyl ester Formula: C23H21F3N2O5S MolecularWeight: 494.48345

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCN1S(=O)(=O)C2=CC=C(C=C2)CC3=CC4=C(C=C3)NC(=O)C=C4C(F)(F)F

Isomeric SMILES

COC(=O)C1CCCN1S(=O)(=O)C2=CC=C(C=C2)CC3=CC4=C(C=C3)NC(=O)C=C4C(F)(F)F

InChI

InChI=1S/C23H21F3N2O5S/c1-33-22(30)20-3-2-10-28(20)34(31,32)16-7-4-14(5-8-16)11-15-6-9-19-17(12-15)18(23(24,25)26)13-21(29)27-19/h4-9,12-13,20H,2-3,10-11H2,1H3,(H,27,29)