3-[(4-sulfanylphenyl)amino]propanoic acid

Systemtic Name: 3-[(4-sulfanylphenyl)amino]propanoic acid Openeye Name: 3-(4-sulfanylanilino)propanoic acid CAS Name: 3-(4-mercaptoanilino)propanoic acid IUPAC Name: 3-(4-sulfanylanilino)propanoic acid Traditional Name: 3-(4-mercaptoanilino)propionic acid Formula: C9H11NO2S MolecularWeight: 197.25414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCCC(=O)O)S

Isomeric SMILES

C1=CC(=CC=C1NCCC(=O)O)S

InChI

InChI=1S/C9H11NO2S/c11-9(12)5-6-10-7-1-3-8(13)4-2-7/h1-4,10,13H,5-6H2,(H,11,12)