[3-(trifluoromethyl)phenyl]methyl 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate

Systemtic Name: [3-(trifluoromethyl)phenyl]methyl 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate Openeye Name: [3-(trifluoromethyl)phenyl]methyl 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate CAS Name: 4-(1-pyrrolidinylsulfonyl)-1H-pyrrole-2-carboxylic acid [3-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [3-(trifluoromethyl)phenyl]methyl 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate Traditional Name: 4-pyrrolidinosulfonyl-1H-pyrrole-2-carboxylic acid [3-(trifluoromethyl)benzyl] ester Formula: C17H17F3N2O4S MolecularWeight: 402.38809

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CNC(=C2)C(=O)OCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CNC(=C2)C(=O)OCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C17H17F3N2O4S/c18-17(19,20)13-5-3-4-12(8-13)11-26-16(23)15-9-14(10-21-15)27(24,25)22-6-1-2-7-22/h3-5,8-10,21H,1-2,6-7,11H2