1-[[3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)imidazol-4-yl]methyl]-4-(methoxymethyl)piperidin-1-ium

Systemtic Name: 1-[[3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)imidazol-4-yl]methyl]-4-(methoxymethyl)piperidin-1-ium Openeye Name: 1-[[3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)imidazol-4-yl]methyl]-4-(methoxymethyl)piperidin-1-ium CAS Name: 1-[[3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)-4-imidazolyl]methyl]-4-(methoxymethyl)piperidin-1-ium IUPAC Name: 1-[[3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)imidazol-4-yl]methyl]-4-(methoxymethyl)piperidin-1-ium Traditional Name: 1-[[3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)imidazol-4-yl]methyl]-4-(methoxymethyl)piperidin-1-ium Formula: C22H38N3O3S+ MolecularWeight: 424.62042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC1CC[NH+](CC1)CC2=CN=C(N2CC3CCCCC3)S(=O)(=O)CC4CC4

Isomeric SMILES

COCC1CC[NH+](CC1)CC2=CN=C(N2CC3CCCCC3)S(=O)(=O)CC4CC4

InChI

InChI=1S/C22H37N3O3S/c1-28-16-19-9-11-24(12-10-19)15-21-13-23-22(29(26,27)17-20-7-8-20)25(21)14-18-5-3-2-4-6-18/h13,18-20H,2-12,14-17H2,1H3/p+1