[2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 3-acetamidobenzoate

Systemtic Name: [2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 3-acetamidobenzoate Openeye Name: [2-(4-methylsulfanylphenyl)-2-oxo-ethyl] 3-acetamidobenzoate CAS Name: 3-acetamidobenzoic acid [2-[4-(methylthio)phenyl]-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfanylphenyl)-2-oxoethyl] 3-acetamidobenzoate Traditional Name: 3-acetamidobenzoic acid [2-keto-2-[4-(methylthio)phenyl]ethyl] ester Formula: C18H17NO4S MolecularWeight: 343.39688

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)SC

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)SC

InChI

InChI=1S/C18H17NO4S/c1-12(20)19-15-5-3-4-14(10-15)18(22)23-11-17(21)13-6-8-16(24-2)9-7-13/h3-10H,11H2,1-2H3,(H,19,20)