[2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] 1-methylsulfonylpiperidine-4-carboxylate

Systemtic Name: [2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] 1-methylsulfonylpiperidine-4-carboxylate Openeye Name: [2-(1,1-dimethylpropylamino)-2-oxo-ethyl] 1-methylsulfonylpiperidine-4-carboxylate CAS Name: 1-methylsulfonyl-4-piperidinecarboxylic acid [2-(2-methylbutan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylbutan-2-ylamino)-2-oxoethyl] 1-methylsulfonylpiperidine-4-carboxylate Traditional Name: 1-mesylisonipecotic acid [2-(tert-amylamino)-2-keto-ethyl] ester Formula: C14H26N2O5S MolecularWeight: 334.43164

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)COC(=O)C1CCN(CC1)S(=O)(=O)C

Isomeric SMILES

CCC(C)(C)NC(=O)COC(=O)C1CCN(CC1)S(=O)(=O)C

InChI

InChI=1S/C14H26N2O5S/c1-5-14(2,3)15-12(17)10-21-13(18)11-6-8-16(9-7-11)22(4,19)20/h11H,5-10H2,1-4H3,(H,15,17)