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

Systemtic Name: 2-[2-[(4-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: 2-[2-[(4-methoxyphenyl)methylamino]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]thio]acetate IUPAC Name: 2-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-(p-anisylamino)ethyl]thio]acetate Formula: C12H14NO4S- MolecularWeight: 268.30886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO4S/c1-17-10-4-2-9(3-5-10)6-13-11(14)7-18-8-12(15)16/h2-5H,6-8H2,1H3,(H,13,14)(H,15,16)/p-1