(3-chloranyl-2-oxidanyl-propyl)-methyl-bis(prop-2-enyl)azanium; methyl sulfate

Systemtic Name: (3-chloranyl-2-oxidanyl-propyl)-methyl-bis(prop-2-enyl)azanium; methyl sulfate Openeye Name: diallyl-(3-chloro-2-hydroxy-propyl)-methyl-ammonium; methyl sulfate CAS Name: (3-chloro-2-hydroxypropyl)-methyl-bis(prop-2-enyl)ammonium; methyl sulfate IUPAC Name: (3-chloro-2-hydroxypropyl)-methyl-bis(prop-2-enyl)azanium; methyl sulfate Traditional Name: diallyl-(3-chloro-2-hydroxy-propyl)-methyl-ammonium; methyl sulfate Formula: C11H22ClNO5S MolecularWeight: 315.81408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](CC=C)(CC=C)CC(CCl)O.COS(=O)(=O)[O-]

Isomeric SMILES

C[N+](CC=C)(CC=C)CC(CCl)O.COS(=O)(=O)[O-]

InChI

InChI=1S/C10H19ClNO.CH4O4S/c1-4-6-12(3,7-5-2)9-10(13)8-11;1-5-6(2,3)4/h4-5,10,13H,1-2,6-9H2,3H3;1H3,(H,2,3,4)/q+1;/p-1