2-[[2-(4-hydroxyphenyl)-2-(2-oxidanylethanoylamino)ethanoyl]amino]-3-methylsulfanyl-propanoic acid

Systemtic Name: 2-[[2-(4-hydroxyphenyl)-2-(2-oxidanylethanoylamino)ethanoyl]amino]-3-methylsulfanyl-propanoic acid Openeye Name: 2-[[2-[(2-hydroxyacetyl)amino]-2-(4-hydroxyphenyl)acetyl]amino]-3-methylsulfanyl-propanoic acid CAS Name: 2-[[2-[(2-hydroxy-1-oxoethyl)amino]-2-(4-hydroxyphenyl)-1-oxoethyl]amino]-3-(methylthio)propanoic acid IUPAC Name: 2-[[2-[(2-hydroxyacetyl)amino]-2-(4-hydroxyphenyl)acetyl]amino]-3-methylsulfanylpropanoic acid Traditional Name: 2-[[2-(glycoloylamino)-2-(4-hydroxyphenyl)acetyl]amino]-3-(methylthio)propionic acid Formula: C14H18N2O6S MolecularWeight: 342.36752

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(C(=O)O)NC(=O)C(C1=CC=C(C=C1)O)NC(=O)CO

Isomeric SMILES

CSCC(C(=O)O)NC(=O)C(C1=CC=C(C=C1)O)NC(=O)CO

InChI

InChI=1S/C14H18N2O6S/c1-23-7-10(14(21)22)15-13(20)12(16-11(19)6-17)8-2-4-9(18)5-3-8/h2-5,10,12,17-18H,6-7H2,1H3,(H,15,20)(H,16,19)(H,21,22)