[3-(2-methoxyethyl)-2-(3-methylbutylsulfonyl)imidazol-4-yl]methyl-methyl-phenethyl-azanium

Systemtic Name: [3-(2-methoxyethyl)-2-(3-methylbutylsulfonyl)imidazol-4-yl]methyl-methyl-phenethyl-azanium Openeye Name: [2-isopentylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl-methyl-phenethyl-ammonium CAS Name: [3-(2-methoxyethyl)-2-(3-methylbutylsulfonyl)-4-imidazolyl]methyl-methyl-phenethylammonium IUPAC Name: [3-(2-methoxyethyl)-2-(3-methylbutylsulfonyl)imidazol-4-yl]methyl-methyl-phenethylazanium Traditional Name: [2-isoamylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl-methyl-phenethyl-ammonium Formula: C21H34N3O3S+ MolecularWeight: 408.57796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCS(=O)(=O)C1=NC=C(N1CCOC)C[NH+](C)CCC2=CC=CC=C2

Isomeric SMILES

CC(C)CCS(=O)(=O)C1=NC=C(N1CCOC)C[NH+](C)CCC2=CC=CC=C2

InChI

InChI=1S/C21H33N3O3S/c1-18(2)11-15-28(25,26)21-22-16-20(24(21)13-14-27-4)17-23(3)12-10-19-8-6-5-7-9-19/h5-9,16,18H,10-15,17H2,1-4H3/p+1