[2-[3,4-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl] 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate

Systemtic Name: [2-[3,4-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl] 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate Openeye Name: [2-(3,4-difluorophenyl)-2-oxo-ethyl] 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate CAS Name: 4-(1-pyrrolidinylsulfonyl)-1H-pyrrole-2-carboxylic acid [2-(3,4-difluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-difluorophenyl)-2-oxoethyl] 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate Traditional Name: 4-pyrrolidinosulfonyl-1H-pyrrole-2-carboxylic acid [2-(3,4-difluorophenyl)-2-keto-ethyl] ester Formula: C17H16F2N2O5S MolecularWeight: 398.381146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16F2N2O5S/c18-13-4-3-11(7-14(13)19)16(22)10-26-17(23)15-8-12(9-20-15)27(24,25)21-5-1-2-6-21/h3-4,7-9,20H,1-2,5-6,10H2