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

Systemtic Name: methyl 3-[2-(3,4-dimethoxyphenyl)sulfanylethanoylamino]benzoate Openeye Name: methyl 3-[[2-(3,4-dimethoxyphenyl)sulfanylacetyl]amino]benzoate CAS Name: 3-[[2-[(3,4-dimethoxyphenyl)thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(3,4-dimethoxyphenyl)sulfanylacetyl]amino]benzoate Traditional Name: 3-[[2-[(3,4-dimethoxyphenyl)thio]acetyl]amino]benzoic acid methyl ester Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SCC(=O)NC2=CC=CC(=C2)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)SCC(=O)NC2=CC=CC(=C2)C(=O)OC)OC

InChI

InChI=1S/C18H19NO5S/c1-22-15-8-7-14(10-16(15)23-2)25-11-17(20)19-13-6-4-5-12(9-13)18(21)24-3/h4-10H,11H2,1-3H3,(H,19,20)