1-[[3-[[(2R)-oxolan-2-yl]methyl]-2-propylsulfonyl-imidazol-4-yl]methyl]azocan-1-ium

Systemtic Name: 1-[[3-[[(2R)-oxolan-2-yl]methyl]-2-propylsulfonyl-imidazol-4-yl]methyl]azocan-1-ium Openeye Name: 1-[[2-propylsulfonyl-3-[[(2R)-tetrahydrofuran-2-yl]methyl]imidazol-4-yl]methyl]azocan-1-ium CAS Name: 1-[[3-[[(2R)-2-oxolanyl]methyl]-2-propylsulfonyl-4-imidazolyl]methyl]azocan-1-ium IUPAC Name: 1-[[3-[[(2R)-oxolan-2-yl]methyl]-2-propylsulfonylimidazol-4-yl]methyl]azocan-1-ium Traditional Name: 1-[[2-propylsulfonyl-3-[[(2R)-tetrahydrofuran-2-yl]methyl]imidazol-4-yl]methyl]azocan-1-ium Formula: C19H34N3O3S+ MolecularWeight: 384.55656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=NC=C(N1CC2CCCO2)C[NH+]3CCCCCCC3

Isomeric SMILES

CCCS(=O)(=O)C1=NC=C(N1C[C@H]2CCCO2)C[NH+]3CCCCCCC3

InChI

InChI=1S/C19H33N3O3S/c1-2-13-26(23,24)19-20-14-17(22(19)16-18-9-8-12-25-18)15-21-10-6-4-3-5-7-11-21/h14,18H,2-13,15-16H2,1H3/p+1/t18-/m1/s1