[2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 2-(2,2-dimethylpropanoylamino)-4,5-dimethoxy-benzoate

Systemtic Name: [2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 2-(2,2-dimethylpropanoylamino)-4,5-dimethoxy-benzoate Openeye Name: [2-(4-methylsulfanylphenyl)-2-oxo-ethyl] 2-(2,2-dimethylpropanoylamino)-4,5-dimethoxy-benzoate CAS Name: 2-[(2,2-dimethyl-1-oxopropyl)amino]-4,5-dimethoxybenzoic acid [2-[4-(methylthio)phenyl]-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfanylphenyl)-2-oxoethyl] 2-(2,2-dimethylpropanoylamino)-4,5-dimethoxybenzoate Traditional Name: 4,5-dimethoxy-2-(pivaloylamino)benzoic acid [2-keto-2-[4-(methylthio)phenyl]ethyl] ester Formula: C23H27NO6S MolecularWeight: 445.52858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC(=C(C=C1C(=O)OCC(=O)C2=CC=C(C=C2)SC)OC)OC

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC(=C(C=C1C(=O)OCC(=O)C2=CC=C(C=C2)SC)OC)OC

InChI

InChI=1S/C23H27NO6S/c1-23(2,3)22(27)24-17-12-20(29-5)19(28-4)11-16(17)21(26)30-13-18(25)14-7-9-15(31-6)10-8-14/h7-12H,13H2,1-6H3,(H,24,27)