(3,3-dimethyl-2-oxidanylidene-butyl) 2-[2-[2-(2-methoxyphenoxy)ethylamino]-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-[2-[2-(2-methoxyphenoxy)ethylamino]-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-[2-[2-(2-methoxyphenoxy)ethylamino]-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-[2-(2-methoxyphenoxy)ethylamino]-2-oxoethyl]thio]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-[2-[2-(2-methoxyphenoxy)ethylamino]-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-keto-2-[2-(2-methoxyphenoxy)ethylamino]ethyl]thio]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C24H29NO6S MolecularWeight: 459.55516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1SCC(=O)NCCOC2=CC=CC=C2OC

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1SCC(=O)NCCOC2=CC=CC=C2OC

InChI

InChI=1S/C24H29NO6S/c1-24(2,3)21(26)15-31-23(28)17-9-5-8-12-20(17)32-16-22(27)25-13-14-30-19-11-7-6-10-18(19)29-4/h5-12H,13-16H2,1-4H3,(H,25,27)