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

Systemtic Name: (2R)-1-[1-[3-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]carbonylpyrrolidine-2-carboxylate Openeye Name: (2R)-1-[1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carbonyl]pyrrolidine-2-carboxylate CAS Name: (2R)-1-[oxo-[1-[3-(trifluoromethyl)phenyl]sulfonyl-4-piperidinyl]methyl]-2-pyrrolidinecarboxylate IUPAC Name: (2R)-1-[1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carbonyl]pyrrolidine-2-carboxylate Traditional Name: (2R)-1-[1-[3-(trifluoromethyl)phenyl]sulfonylisonipecotoyl]pyrrolidine-2-carboxylate Formula: C18H20F3N2O5S- MolecularWeight: 433.42201

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)C(=O)[O-]

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)C(=O)[O-]

InChI

InChI=1S/C18H21F3N2O5S/c19-18(20,21)13-3-1-4-14(11-13)29(27,28)22-9-6-12(7-10-22)16(24)23-8-2-5-15(23)17(25)26/h1,3-4,11-12,15H,2,5-10H2,(H,25,26)/p-1/t15-/m1/s1