ethyl 1-(4-methoxyphenyl)sulfonyl-4-(oxan-2-ylmethyl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-(4-methoxyphenyl)sulfonyl-4-(oxan-2-ylmethyl)piperidine-4-carboxylate Openeye Name: ethyl 1-(4-methoxyphenyl)sulfonyl-4-(tetrahydropyran-2-ylmethyl)piperidine-4-carboxylate CAS Name: 1-(4-methoxyphenyl)sulfonyl-4-(2-oxanylmethyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-methoxyphenyl)sulfonyl-4-(oxan-2-ylmethyl)piperidine-4-carboxylate Traditional Name: 1-(4-methoxyphenyl)sulfonyl-4-(tetrahydropyran-2-ylmethyl)isonipecotic acid ethyl ester Formula: C21H31NO6S MolecularWeight: 425.53894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)OC)CC3CCCCO3

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)OC)CC3CCCCO3

InChI

InChI=1S/C21H31NO6S/c1-3-27-20(23)21(16-18-6-4-5-15-28-18)11-13-22(14-12-21)29(24,25)19-9-7-17(26-2)8-10-19/h7-10,18H,3-6,11-16H2,1-2H3