[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]methyl 1-methylsulfonylpiperidine-4-carboxylate

Systemtic Name: [1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]methyl 1-methylsulfonylpiperidine-4-carboxylate Openeye Name: (1,3-dimethyl-2,6-dioxo-pyrimidin-4-yl)methyl 1-methylsulfonylpiperidine-4-carboxylate CAS Name: 1-methylsulfonyl-4-piperidinecarboxylic acid (1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)methyl ester IUPAC Name: (1,3-dimethyl-2,6-dioxopyrimidin-4-yl)methyl 1-methylsulfonylpiperidine-4-carboxylate Traditional Name: 1-mesylisonipecotic acid (2,6-diketo-1,3-dimethyl-pyrimidin-4-yl)methyl ester Formula: C14H21N3O6S MolecularWeight: 359.39804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C)COC(=O)C2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C)COC(=O)C2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C14H21N3O6S/c1-15-11(8-12(18)16(2)14(15)20)9-23-13(19)10-4-6-17(7-5-10)24(3,21)22/h8,10H,4-7,9H2,1-3H3