[1-(2-dimethylaminoethyl)pyridin-1-ium-4-yl]-phenyl-methanone chloride hydrochloride

Systemtic Name: [1-(2-dimethylaminoethyl)pyridin-1-ium-4-yl]-phenyl-methanone chloride hydrochloride Openeye Name: [1-(2-dimethylaminoethyl)pyridin-1-ium-4-yl]-phenyl-methanone chloride hydrochloride CAS Name: [1-(2-dimethylaminoethyl)-4-pyridin-1-iumyl]-phenylmethanone chloride hydrochloride IUPAC Name: [1-(2-dimethylaminoethyl)pyridin-1-ium-4-yl]-phenylmethanone chloride hydrochloride Traditional Name: [1-(2-dimethylaminoethyl)pyridin-1-ium-4-yl]-phenyl-methanone chloride hydrochloride Formula: C16H20Cl2N2O MolecularWeight: 327.2488

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC[N+]1=CC=C(C=C1)C(=O)C2=CC=CC=C2.Cl.[Cl-]

Isomeric SMILES

CN(C)CC[N+]1=CC=C(C=C1)C(=O)C2=CC=CC=C2.Cl.[Cl-]

InChI

InChI=1S/C16H19N2O.2ClH/c1-17(2)12-13-18-10-8-15(9-11-18)16(19)14-6-4-3-5-7-14;;/h3-11H,12-13H2,1-2H3;2*1H/q+1;;/p-1