1-[[2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-methoxy-piperidin-1-ium

Systemtic Name: 1-[[2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-methoxy-piperidin-1-ium Openeye Name: 1-[[2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-methoxy-piperidin-1-ium CAS Name: 1-[[2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)-4-imidazolyl]methyl]-4-methoxypiperidin-1-ium IUPAC Name: 1-[[2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-methoxypiperidin-1-ium Traditional Name: 1-[[2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-methoxy-piperidin-1-ium Formula: C20H36N3O4S+ MolecularWeight: 414.58254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=CN=C1S(=O)(=O)CC2CCCCC2)C[NH+]3CCC(CC3)OC

Isomeric SMILES

COCCN1C(=CN=C1S(=O)(=O)CC2CCCCC2)C[NH+]3CCC(CC3)OC

InChI

InChI=1S/C20H35N3O4S/c1-26-13-12-23-18(15-22-10-8-19(27-2)9-11-22)14-21-20(23)28(24,25)16-17-6-4-3-5-7-17/h14,17,19H,3-13,15-16H2,1-2H3/p+1