(2,3-dimethoxyphenyl)methyl 2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: (2,3-dimethoxyphenyl)methyl 2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: (2,3-dimethoxyphenyl)methyl 2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(4-methylanilino)-2-oxoethyl]thio]acetic acid (2,3-dimethoxyphenyl)methyl ester IUPAC Name: (2,3-dimethoxyphenyl)methyl 2-[2-(4-methylanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-(p-toluidino)ethyl]thio]acetic acid o-veratryl ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSCC(=O)OCC2=C(C(=CC=C2)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSCC(=O)OCC2=C(C(=CC=C2)OC)OC

InChI

InChI=1S/C20H23NO5S/c1-14-7-9-16(10-8-14)21-18(22)12-27-13-19(23)26-11-15-5-4-6-17(24-2)20(15)25-3/h4-10H,11-13H2,1-3H3,(H,21,22)