3-[2-(2-methylphenyl)sulfanylethanoylamino]benzoic acid

Systemtic Name: 3-[2-(2-methylphenyl)sulfanylethanoylamino]benzoic acid Openeye Name: 3-[[2-(o-tolylsulfanyl)acetyl]amino]benzoic acid CAS Name: 3-[[2-[(2-methylphenyl)thio]-1-oxoethyl]amino]benzoic acid IUPAC Name: 3-[[2-(2-methylphenyl)sulfanylacetyl]amino]benzoic acid Traditional Name: 3-[[2-(o-tolylthio)acetyl]amino]benzoic acid Formula: C16H15NO3S MolecularWeight: 301.3602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)NC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)NC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C16H15NO3S/c1-11-5-2-3-8-14(11)21-10-15(18)17-13-7-4-6-12(9-13)16(19)20/h2-9H,10H2,1H3,(H,17,18)(H,19,20)