2-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 2-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 2-[2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 2-[[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]thio]propanoic acid IUPAC Name: 2-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 2-[[2-[(4-chlorobenzyl)amino]-2-keto-ethyl]thio]propionic acid Formula: C12H14ClNO3S MolecularWeight: 287.76246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC(=O)NCC1=CC=C(C=C1)Cl

Isomeric SMILES

CC(C(=O)O)SCC(=O)NCC1=CC=C(C=C1)Cl

InChI

InChI=1S/C12H14ClNO3S/c1-8(12(16)17)18-7-11(15)14-6-9-2-4-10(13)5-3-9/h2-5,8H,6-7H2,1H3,(H,14,15)(H,16,17)