bis(2-hydroxyethyl)-methyl-[(4-methylsulfonylphenyl)methyl]azanium chloride

Systemtic Name: bis(2-hydroxyethyl)-methyl-[(4-methylsulfonylphenyl)methyl]azanium chloride Openeye Name: bis(2-hydroxyethyl)-methyl-[(4-methylsulfonylphenyl)methyl]ammonium chloride CAS Name: bis(2-hydroxyethyl)-methyl-[(4-methylsulfonylphenyl)methyl]ammonium chloride IUPAC Name: bis(2-hydroxyethyl)-methyl-[(4-methylsulfonylphenyl)methyl]azanium chloride Traditional Name: bis(2-hydroxyethyl)-(4-mesylbenzyl)-methyl-ammonium chloride Formula: C13H22ClNO4S MolecularWeight: 323.83608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](CCO)(CCO)CC1=CC=C(C=C1)S(=O)(=O)C.[Cl-]

Isomeric SMILES

C[N+](CCO)(CCO)CC1=CC=C(C=C1)S(=O)(=O)C.[Cl-]

InChI

InChI=1S/C13H22NO4S.ClH/c1-14(7-9-15,8-10-16)11-12-3-5-13(6-4-12)19(2,17)18;/h3-6,15-16H,7-11H2,1-2H3;1H/q+1;/p-1