1-(2-dimethylaminoethyl)pyridin-1-ium-3-ol chloride hydrochloride

Systemtic Name: 1-(2-dimethylaminoethyl)pyridin-1-ium-3-ol chloride hydrochloride Openeye Name: 1-(2-dimethylaminoethyl)pyridin-1-ium-3-ol chloride hydrochloride CAS Name: 1-(2-dimethylaminoethyl)-3-pyridin-1-iumol chloride hydrochloride IUPAC Name: 1-(2-dimethylaminoethyl)pyridin-1-ium-3-ol chloride hydrochloride Traditional Name: 1-(2-dimethylaminoethyl)pyridin-1-ium-3-ol chloride hydrochloride Formula: C9H16Cl2N2O MolecularWeight: 239.14214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC[N+]1=CC=CC(=C1)O.Cl.[Cl-]

Isomeric SMILES

CN(C)CC[N+]1=CC=CC(=C1)O.Cl.[Cl-]

InChI

InChI=1S/C9H14N2O.2ClH/c1-10(2)6-7-11-5-3-4-9(12)8-11;;/h3-5,8H,6-7H2,1-2H3;2*1H