(2-azanyl-2-oxidanylidene-ethyl) 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (2-amino-2-oxo-ethyl) 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-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=C(C=C2)C(=O)OCC(=O)N

Isomeric SMILES

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

InChI

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