methyl-[[2-methylsulfonyl-3-[[(2R)-oxolan-2-yl]methyl]imidazol-4-yl]methyl]-(3-pyrrolidin-1-ium-1-ylpropyl)azanium

Systemtic Name: methyl-[[2-methylsulfonyl-3-[[(2R)-oxolan-2-yl]methyl]imidazol-4-yl]methyl]-(3-pyrrolidin-1-ium-1-ylpropyl)azanium Openeye Name: methyl-[[2-methylsulfonyl-3-[[(2R)-tetrahydrofuran-2-yl]methyl]imidazol-4-yl]methyl]-(3-pyrrolidin-1-ium-1-ylpropyl)ammonium CAS Name: methyl-[[2-methylsulfonyl-3-[[(2R)-2-oxolanyl]methyl]-4-imidazolyl]methyl]-[3-(1-pyrrolidin-1-iumyl)propyl]ammonium IUPAC Name: methyl-[[2-methylsulfonyl-3-[[(2R)-oxolan-2-yl]methyl]imidazol-4-yl]methyl]-(3-pyrrolidin-1-ium-1-ylpropyl)azanium Traditional Name: [2-mesyl-3-[[(2R)-tetrahydrofuran-2-yl]methyl]imidazol-4-yl]methyl-methyl-(3-pyrrolidin-1-ium-1-ylpropyl)ammonium Formula: C18H34N4O3S+2 MolecularWeight: 386.55256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC[NH+]1CCCC1)CC2=CN=C(N2CC3CCCO3)S(=O)(=O)C

Isomeric SMILES

C[NH+](CCC[NH+]1CCCC1)CC2=CN=C(N2C[C@H]3CCCO3)S(=O)(=O)C

InChI

InChI=1S/C18H32N4O3S/c1-20(8-6-11-21-9-3-4-10-21)14-16-13-19-18(26(2,23)24)22(16)15-17-7-5-12-25-17/h13,17H,3-12,14-15H2,1-2H3/p+2/t17-/m1/s1