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

Systemtic Name: [2-(ethylcarbamoylamino)-2-oxidanylidene-ethyl] 1-methylsulfonylpiperidine-4-carboxylate Openeye Name: [2-(ethylcarbamoylamino)-2-oxo-ethyl] 1-methylsulfonylpiperidine-4-carboxylate CAS Name: 1-methylsulfonyl-4-piperidinecarboxylic acid [2-(ethylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(ethylcarbamoylamino)-2-oxoethyl] 1-methylsulfonylpiperidine-4-carboxylate Traditional Name: 1-mesylisonipecotic acid [2-(ethylcarbamoylamino)-2-keto-ethyl] ester Formula: C12H21N3O6S MolecularWeight: 335.37664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H21N3O6S/c1-3-13-12(18)14-10(16)8-21-11(17)9-4-6-15(7-5-9)22(2,19)20/h9H,3-8H2,1-2H3,(H2,13,14,16,18)