2-azanyl-3-sulfanyl-propanoic acid; N-(4-hydroxyphenyl)ethanamide

Systemtic Name: 2-azanyl-3-sulfanyl-propanoic acid; N-(4-hydroxyphenyl)ethanamide Openeye Name: 2-amino-3-sulfanyl-propanoic acid; N-(4-hydroxyphenyl)acetamide CAS Name: 2-amino-3-mercaptopropanoic acid; N-(4-hydroxyphenyl)acetamide IUPAC Name: 2-amino-3-sulfanylpropanoic acid; N-(4-hydroxyphenyl)acetamide Traditional Name: 2-amino-3-mercapto-propionic acid; N-(4-hydroxyphenyl)acetamide Formula: C11H16N2O4S MolecularWeight: 272.32074

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)O.C(C(C(=O)O)N)S

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)O.C(C(C(=O)O)N)S

InChI

InChI=1S/C8H9NO2.C3H7NO2S/c1-6(10)9-7-2-4-8(11)5-3-7;4-2(1-7)3(5)6/h2-5,11H,1H3,(H,9,10);2,7H,1,4H2,(H,5,6)