2-(methylamino)-3-(4-sulfanylphenyl)propanoic acid

Systemtic Name: 2-(methylamino)-3-(4-sulfanylphenyl)propanoic acid Openeye Name: 2-(methylamino)-3-(4-sulfanylphenyl)propanoic acid CAS Name: 3-(4-mercaptophenyl)-2-(methylamino)propanoic acid IUPAC Name: 2-(methylamino)-3-(4-sulfanylphenyl)propanoic acid Traditional Name: 3-(4-mercaptophenyl)-2-(methylamino)propionic acid Formula: C10H13NO2S MolecularWeight: 211.28072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(CC1=CC=C(C=C1)S)C(=O)O

Isomeric SMILES

CNC(CC1=CC=C(C=C1)S)C(=O)O

InChI

InChI=1S/C10H13NO2S/c1-11-9(10(12)13)6-7-2-4-8(14)5-3-7/h2-5,9,11,14H,6H2,1H3,(H,12,13)