[3-(cyclohexylmethyl)-2-methylsulfonyl-imidazol-4-yl]methyl-methyl-(2-phenoxyethyl)azanium

Systemtic Name: [3-(cyclohexylmethyl)-2-methylsulfonyl-imidazol-4-yl]methyl-methyl-(2-phenoxyethyl)azanium Openeye Name: [3-(cyclohexylmethyl)-2-methylsulfonyl-imidazol-4-yl]methyl-methyl-(2-phenoxyethyl)ammonium CAS Name: [3-(cyclohexylmethyl)-2-methylsulfonyl-4-imidazolyl]methyl-methyl-(2-phenoxyethyl)ammonium IUPAC Name: [3-(cyclohexylmethyl)-2-methylsulfonylimidazol-4-yl]methyl-methyl-(2-phenoxyethyl)azanium Traditional Name: [3-(cyclohexylmethyl)-2-mesyl-imidazol-4-yl]methyl-methyl-(2-phenoxyethyl)ammonium Formula: C21H32N3O3S+ MolecularWeight: 406.56208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCOC1=CC=CC=C1)CC2=CN=C(N2CC3CCCCC3)S(=O)(=O)C

Isomeric SMILES

C[NH+](CCOC1=CC=CC=C1)CC2=CN=C(N2CC3CCCCC3)S(=O)(=O)C

InChI

InChI=1S/C21H31N3O3S/c1-23(13-14-27-20-11-7-4-8-12-20)17-19-15-22-21(28(2,25)26)24(19)16-18-9-5-3-6-10-18/h4,7-8,11-12,15,18H,3,5-6,9-10,13-14,16-17H2,1-2H3/p+1