methyl 2-[2-(3,4-dimethoxyphenyl)sulfanylethanoylamino]-4,5-dimethoxy-benzoate

Systemtic Name: methyl 2-[2-(3,4-dimethoxyphenyl)sulfanylethanoylamino]-4,5-dimethoxy-benzoate Openeye Name: methyl 2-[[2-(3,4-dimethoxyphenyl)sulfanylacetyl]amino]-4,5-dimethoxy-benzoate CAS Name: 2-[[2-[(3,4-dimethoxyphenyl)thio]-1-oxoethyl]amino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[[2-(3,4-dimethoxyphenyl)sulfanylacetyl]amino]-4,5-dimethoxybenzoate Traditional Name: 2-[[2-[(3,4-dimethoxyphenyl)thio]acetyl]amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C20H23NO7S MolecularWeight: 421.46412

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SCC(=O)NC2=CC(=C(C=C2C(=O)OC)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)SCC(=O)NC2=CC(=C(C=C2C(=O)OC)OC)OC)OC

InChI

InChI=1S/C20H23NO7S/c1-24-15-7-6-12(8-16(15)25-2)29-11-19(22)21-14-10-18(27-4)17(26-3)9-13(14)20(23)28-5/h6-10H,11H2,1-5H3,(H,21,22)