methyl 1-[1-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]carbonylpyrrolidine-2-carboxylate

Systemtic Name: methyl 1-[1-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]carbonylpyrrolidine-2-carboxylate Openeye Name: methyl 1-[1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carbonyl]pyrrolidine-2-carboxylate CAS Name: 1-[[1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-4-piperidinyl]-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carbonyl]pyrrolidine-2-carboxylate Traditional Name: 1-[1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylisonipecotoyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C19H22ClF3N2O5S MolecularWeight: 482.90159

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCN1C(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

COC(=O)C1CCCN1C(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C19H22ClF3N2O5S/c1-30-18(27)16-3-2-8-25(16)17(26)12-6-9-24(10-7-12)31(28,29)13-4-5-15(20)14(11-13)19(21,22)23/h4-5,11-12,16H,2-3,6-10H2,1H3