(3,3-dimethyl-2-oxidanylidene-butyl) 2-[2-[(4-methoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-[2-[(4-methoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-[2-(4-methoxycarbonylanilino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(4-methoxycarbonylanilino)-2-oxoethyl]thio]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-[2-(4-methoxycarbonylanilino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-(4-carbomethoxyanilino)-2-keto-ethyl]thio]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C23H25NO6S MolecularWeight: 443.5127

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1SCC(=O)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1SCC(=O)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C23H25NO6S/c1-23(2,3)19(25)13-30-22(28)17-7-5-6-8-18(17)31-14-20(26)24-16-11-9-15(10-12-16)21(27)29-4/h5-12H,13-14H2,1-4H3,(H,24,26)