(3-chloranyl-2-oxidanyl-propyl)-trimethyl-azanium ethanoate hydrochloride

Systemtic Name: (3-chloranyl-2-oxidanyl-propyl)-trimethyl-azanium ethanoate hydrochloride Openeye Name: (3-chloro-2-hydroxy-propyl)-trimethyl-ammonium acetate hydrochloride CAS Name: (3-chloro-2-hydroxypropyl)-trimethylammonium acetate hydrochloride IUPAC Name: (3-chloro-2-hydroxypropyl)-trimethylazanium acetate hydrochloride Traditional Name: (3-chloro-2-hydroxy-propyl)-trimethyl-ammonium acetate hydrochloride Formula: C8H19Cl2NO3 MolecularWeight: 248.14736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H15ClNO.C2H4O2.ClH/c1-8(2,3)5-6(9)4-7;1-2(3)4;/h6,9H,4-5H2,1-3H3;1H3,(H,3,4);1H/q+1;;/p-1