(2-azanyl-2-oxidanylidene-ethyl) 2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: (2-amino-2-oxo-ethyl) 2-hydroxy-5-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 2-hydroxy-5-(1-pyrrolidinylsulfonyl)benzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 2-hydroxy-5-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 2-hydroxy-5-pyrrolidinosulfonyl-benzoic acid (2-amino-2-keto-ethyl) ester Formula: C13H16N2O6S MolecularWeight: 328.34094

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)O)C(=O)OCC(=O)N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)O)C(=O)OCC(=O)N

InChI

InChI=1S/C13H16N2O6S/c14-12(17)8-21-13(18)10-7-9(3-4-11(10)16)22(19,20)15-5-1-2-6-15/h3-4,7,16H,1-2,5-6,8H2,(H2,14,17)