2-[(4-acetamidophenyl)carbonylamino]-3-(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanyl-propanoate

Systemtic Name: 2-[(4-acetamidophenyl)carbonylamino]-3-(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanyl-propanoate Openeye Name: 2-[(4-acetamidobenzoyl)amino]-3-(2-oxido-2-oxo-ethyl)sulfanyl-propanoate CAS Name: 2-[[(4-acetamidophenyl)-oxomethyl]amino]-3-[(2-oxido-2-oxoethyl)thio]propanoate IUPAC Name: 2-[(4-acetamidobenzoyl)amino]-3-(2-oxido-2-oxoethyl)sulfanylpropanoate Traditional Name: 2-[(4-acetamidobenzoyl)amino]-3-[(2-keto-2-oxido-ethyl)thio]propionate Formula: C14H14N2O6S-2 MolecularWeight: 338.33576

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)NC(CSCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)NC(CSCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C14H16N2O6S/c1-8(17)15-10-4-2-9(3-5-10)13(20)16-11(14(21)22)6-23-7-12(18)19/h2-5,11H,6-7H2,1H3,(H,15,17)(H,16,20)(H,18,19)(H,21,22)/p-2