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

Systemtic Name: 4,5-dimethoxy-2-[2-(4-methylphenyl)sulfanylethanoylamino]benzoic acid Openeye Name: 4,5-dimethoxy-2-[[2-(p-tolylsulfanyl)acetyl]amino]benzoic acid CAS Name: 4,5-dimethoxy-2-[[2-[(4-methylphenyl)thio]-1-oxoethyl]amino]benzoic acid IUPAC Name: 4,5-dimethoxy-2-[[2-(4-methylphenyl)sulfanylacetyl]amino]benzoic acid Traditional Name: 4,5-dimethoxy-2-[[2-(p-tolylthio)acetyl]amino]benzoic acid Formula: C18H19NO5S MolecularWeight: 361.41216

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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)