2-[2-(4-hydroxyphenyl)ethanoylamino]-3-methylsulfanyl-propanoic acid

Systemtic Name: 2-[2-(4-hydroxyphenyl)ethanoylamino]-3-methylsulfanyl-propanoic acid Openeye Name: 2-[[2-(4-hydroxyphenyl)acetyl]amino]-3-methylsulfanyl-propanoic acid CAS Name: 2-[[2-(4-hydroxyphenyl)-1-oxoethyl]amino]-3-(methylthio)propanoic acid IUPAC Name: 2-[[2-(4-hydroxyphenyl)acetyl]amino]-3-methylsulfanylpropanoic acid Traditional Name: 2-[[2-(4-hydroxyphenyl)acetyl]amino]-3-(methylthio)propionic acid Formula: C12H15NO4S MolecularWeight: 269.3168

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(C(=O)O)NC(=O)CC1=CC=C(C=C1)O

Isomeric SMILES

CSCC(C(=O)O)NC(=O)CC1=CC=C(C=C1)O

InChI

InChI=1S/C12H15NO4S/c1-18-7-10(12(16)17)13-11(15)6-8-2-4-9(14)5-3-8/h2-5,10,14H,6-7H2,1H3,(H,13,15)(H,16,17)