2-[(4R)-4-cyano-2-oxidanylidene-pyrrolidin-1-yl]-4-ethylsulfonyl-phenolate

Systemtic Name: 2-[(4R)-4-cyano-2-oxidanylidene-pyrrolidin-1-yl]-4-ethylsulfonyl-phenolate Openeye Name: 2-[(4R)-4-cyano-2-oxo-pyrrolidin-1-yl]-4-ethylsulfonyl-phenolate CAS Name: 2-[(4R)-4-cyano-2-oxo-1-pyrrolidinyl]-4-ethylsulfonylphenolate IUPAC Name: 2-[(4R)-4-cyano-2-oxopyrrolidin-1-yl]-4-ethylsulfonylphenolate Traditional Name: 2-[(4R)-4-cyano-2-keto-pyrrolidino]-4-esyl-phenolate Formula: C13H13N2O4S- MolecularWeight: 293.31832

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)[O-])N2CC(CC2=O)C#N

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)[O-])N2C[C@@H](CC2=O)C#N

InChI

InChI=1S/C13H14N2O4S/c1-2-20(18,19)10-3-4-12(16)11(6-10)15-8-9(7-14)5-13(15)17/h3-4,6,9,16H,2,5,8H2,1H3/p-1/t9-/m0/s1