methyl 2-[(4-methoxyphenyl)-methyl-amino]-3-sulfanyl-propanoate

Systemtic Name: methyl 2-[(4-methoxyphenyl)-methyl-amino]-3-sulfanyl-propanoate Openeye Name: methyl 2-(4-methoxy-N-methyl-anilino)-3-sulfanyl-propanoate CAS Name: 3-mercapto-2-(4-methoxy-N-methylanilino)propanoic acid methyl ester IUPAC Name: methyl 2-(4-methoxy-N-methylanilino)-3-sulfanylpropanoate Traditional Name: 3-mercapto-2-(4-methoxy-N-methyl-anilino)propionic acid methyl ester Formula: C12H17NO3S MolecularWeight: 255.33328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OC)C(CS)C(=O)OC

Isomeric SMILES

CN(C1=CC=C(C=C1)OC)C(CS)C(=O)OC

InChI

InChI=1S/C12H17NO3S/c1-13(11(8-17)12(14)16-3)9-4-6-10(15-2)7-5-9/h4-7,11,17H,8H2,1-3H3