[2-oxidanylidene-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] 4-methylsulfanylbenzoate

Systemtic Name: [2-oxidanylidene-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] 4-methylsulfanylbenzoate Openeye Name: [2-oxo-2-(1,1,3,3-tetramethylbutylamino)ethyl] 4-methylsulfanylbenzoate CAS Name: 4-(methylthio)benzoic acid [2-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] 4-methylsulfanylbenzoate Traditional Name: 4-(methylthio)benzoic acid [2-keto-2-(1,1,3,3-tetramethylbutylamino)ethyl] ester Formula: C18H27NO3S MolecularWeight: 337.47688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)NC(=O)COC(=O)C1=CC=C(C=C1)SC

Isomeric SMILES

CC(C)(C)CC(C)(C)NC(=O)COC(=O)C1=CC=C(C=C1)SC

InChI

InChI=1S/C18H27NO3S/c1-17(2,3)12-18(4,5)19-15(20)11-22-16(21)13-7-9-14(23-6)10-8-13/h7-10H,11-12H2,1-6H3,(H,19,20)