(2-methoxyphenyl)methyl-methyl-[[3-[[(2R)-oxolan-2-yl]methyl]-2-propylsulfonyl-imidazol-4-yl]methyl]azanium

Systemtic Name: (2-methoxyphenyl)methyl-methyl-[[3-[[(2R)-oxolan-2-yl]methyl]-2-propylsulfonyl-imidazol-4-yl]methyl]azanium Openeye Name: (2-methoxyphenyl)methyl-methyl-[[2-propylsulfonyl-3-[[(2R)-tetrahydrofuran-2-yl]methyl]imidazol-4-yl]methyl]ammonium CAS Name: (2-methoxyphenyl)methyl-methyl-[[3-[[(2R)-2-oxolanyl]methyl]-2-propylsulfonyl-4-imidazolyl]methyl]ammonium IUPAC Name: (2-methoxyphenyl)methyl-methyl-[[3-[[(2R)-oxolan-2-yl]methyl]-2-propylsulfonylimidazol-4-yl]methyl]azanium Traditional Name: methyl-o-anisyl-[[2-propylsulfonyl-3-[[(2R)-tetrahydrofuran-2-yl]methyl]imidazol-4-yl]methyl]ammonium Formula: C21H32N3O4S+ MolecularWeight: 422.56148

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=NC=C(N1CC2CCCO2)C[NH+](C)CC3=CC=CC=C3OC

Isomeric SMILES

CCCS(=O)(=O)C1=NC=C(N1C[C@H]2CCCO2)C[NH+](C)CC3=CC=CC=C3OC

InChI

InChI=1S/C21H31N3O4S/c1-4-12-29(25,26)21-22-13-18(24(21)16-19-9-7-11-28-19)15-23(2)14-17-8-5-6-10-20(17)27-3/h5-6,8,10,13,19H,4,7,9,11-12,14-16H2,1-3H3/p+1/t19-/m1/s1