2-benzamido-3-(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanyl-propanoate

Systemtic Name: 2-benzamido-3-(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanyl-propanoate Openeye Name: 2-benzamido-3-(2-oxido-2-oxo-ethyl)sulfanyl-propanoate CAS Name: 2-benzamido-3-[(2-oxido-2-oxoethyl)thio]propanoate IUPAC Name: 2-benzamido-3-(2-oxido-2-oxoethyl)sulfanylpropanoate Traditional Name: 2-benzamido-3-[(2-keto-2-oxido-ethyl)thio]propionate Formula: C12H11NO5S-2 MolecularWeight: 281.28444

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(CSCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(CSCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C12H13NO5S/c14-10(15)7-19-6-9(12(17)18)13-11(16)8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,13,16)(H,14,15)(H,17,18)/p-2