2-acetamidoethanoate; benzenesulfonate

Systemtic Name: 2-acetamidoethanoate; benzenesulfonate Openeye Name: 2-acetamidoacetate; benzenesulfonate CAS Name: 2-acetamidoacetate; benzenesulfonate IUPAC Name: 2-acetamidoacetate; benzenesulfonate Traditional Name: 2-acetamidoacetate besylate Formula: C10H11NO6S-2 MolecularWeight: 273.26244

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC(=O)[O-].C1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CC(=O)NCC(=O)[O-].C1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C6H6O3S.C4H7NO3/c7-10(8,9)6-4-2-1-3-5-6;1-3(6)5-2-4(7)8/h1-5H,(H,7,8,9);2H2,1H3,(H,5,6)(H,7,8)/p-2