dimethyl 4-cyano-5-methyl-3-piperidin-1-yl-2,5-dihydrothiopyran-6,6-dicarboxylate

Systemtic Name: dimethyl 4-cyano-5-methyl-3-piperidin-1-yl-2,5-dihydrothiopyran-6,6-dicarboxylate Openeye Name: dimethyl 4-cyano-5-methyl-3-(1-piperidyl)-2,5-dihydrothiopyran-6,6-dicarboxylate CAS Name: 4-cyano-5-methyl-3-(1-piperidinyl)-2,5-dihydrothiopyran-6,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-cyano-5-methyl-3-piperidin-1-yl-2,5-dihydrothiopyran-6,6-dicarboxylate Traditional Name: 4-cyano-5-methyl-3-piperidino-2,5-dihydrothiopyran-6,6-dicarboxylic acid dimethyl ester Formula: C16H22N2O4S MolecularWeight: 338.42188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=C(CSC1(C(=O)OC)C(=O)OC)N2CCCCC2)C#N

Isomeric SMILES

CC1C(=C(CSC1(C(=O)OC)C(=O)OC)N2CCCCC2)C#N

InChI

InChI=1S/C16H22N2O4S/c1-11-12(9-17)13(18-7-5-4-6-8-18)10-23-16(11,14(19)21-2)15(20)22-3/h11H,4-8,10H2,1-3H3