2-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: 2-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: 2-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethyl]thio]acetate IUPAC Name: 2-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-[2-(4-methoxyphenyl)ethylamino]ethyl]thio]acetate Formula: C13H16NO4S- MolecularWeight: 282.33544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)CSCC(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)CSCC(=O)[O-]

InChI

InChI=1S/C13H17NO4S/c1-18-11-4-2-10(3-5-11)6-7-14-12(15)8-19-9-13(16)17/h2-5H,6-9H2,1H3,(H,14,15)(H,16,17)/p-1