2-[2-[ethyl-(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoic acid

Systemtic Name: 2-[2-[ethyl-(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoic acid Openeye Name: 2-[2-(N-ethyl-3-methyl-anilino)-2-oxo-ethyl]sulfanylbenzoic acid CAS Name: 2-[[2-(N-ethyl-3-methylanilino)-2-oxoethyl]thio]benzoic acid IUPAC Name: 2-[2-(N-ethyl-3-methylanilino)-2-oxoethyl]sulfanylbenzoic acid Traditional Name: 2-[[2-(N-ethyl-3-methyl-anilino)-2-keto-ethyl]thio]benzoic acid Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C)C(=O)CSC2=CC=CC=C2C(=O)O

Isomeric SMILES

CCN(C1=CC=CC(=C1)C)C(=O)CSC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C18H19NO3S/c1-3-19(14-8-6-7-13(2)11-14)17(20)12-23-16-10-5-4-9-15(16)18(21)22/h4-11H,3,12H2,1-2H3,(H,21,22)