(2-azanyl-2-oxidanylidene-ethyl) 3-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 3-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (2-amino-2-oxo-ethyl) 3-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 3-(1-pyrrolidinylsulfonyl)benzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-pyrrolidinosulfonylbenzoic acid (2-amino-2-keto-ethyl) ester Formula: C13H16N2O5S MolecularWeight: 312.34154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O5S/c14-12(16)9-20-13(17)10-4-3-5-11(8-10)21(18,19)15-6-1-2-7-15/h3-5,8H,1-2,6-7,9H2,(H2,14,16)