2-[2-(4-chlorophenyl)sulfanylethanoyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[2-(4-chlorophenyl)sulfanylethanoyl-methyl-amino]ethanoic acid Openeye Name: 2-[[2-(4-chlorophenyl)sulfanylacetyl]-methyl-amino]acetic acid CAS Name: 2-[[2-[(4-chlorophenyl)thio]-1-oxoethyl]-methylamino]acetic acid IUPAC Name: 2-[[2-(4-chlorophenyl)sulfanylacetyl]-methylamino]acetic acid Traditional Name: 2-[[2-[(4-chlorophenyl)thio]acetyl]-methyl-amino]acetic acid Formula: C11H12ClNO3S MolecularWeight: 273.73588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=O)CSC1=CC=C(C=C1)Cl

Isomeric SMILES

CN(CC(=O)O)C(=O)CSC1=CC=C(C=C1)Cl

InChI

InChI=1S/C11H12ClNO3S/c1-13(6-11(15)16)10(14)7-17-9-4-2-8(12)3-5-9/h2-5H,6-7H2,1H3,(H,15,16)