4,5-dimethoxy-2-[2-(4-methylphenyl)sulfanylethanoylamino]benzoate

Systemtic Name: 4,5-dimethoxy-2-[2-(4-methylphenyl)sulfanylethanoylamino]benzoate Openeye Name: 4,5-dimethoxy-2-[[2-(p-tolylsulfanyl)acetyl]amino]benzoate CAS Name: 4,5-dimethoxy-2-[[2-[(4-methylphenyl)thio]-1-oxoethyl]amino]benzoate IUPAC Name: 4,5-dimethoxy-2-[[2-(4-methylphenyl)sulfanylacetyl]amino]benzoate Traditional Name: 4,5-dimethoxy-2-[[2-(p-tolylthio)acetyl]amino]benzoate Formula: C18H18NO5S- MolecularWeight: 360.40422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NC2=CC(=C(C=C2C(=O)[O-])OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NC2=CC(=C(C=C2C(=O)[O-])OC)OC

InChI

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