1-chloranyl-3-(4-methylpyridin-1-ium-1-yl)propan-2-ol perchlorate

Systemtic Name: 1-chloranyl-3-(4-methylpyridin-1-ium-1-yl)propan-2-ol perchlorate Openeye Name: 1-chloro-3-(4-methylpyridin-1-ium-1-yl)propan-2-ol perchlorate CAS Name: 1-chloro-3-(4-methyl-1-pyridin-1-iumyl)-2-propanol perchlorate IUPAC Name: 1-chloro-3-(4-methylpyridin-1-ium-1-yl)propan-2-ol perchlorate Traditional Name: 1-chloro-3-(4-methylpyridin-1-ium-1-yl)propan-2-ol perchlorate Formula: C9H13Cl2NO5 MolecularWeight: 286.10922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H13ClNO.ClHO4/c1-8-2-4-11(5-3-8)7-9(12)6-10;2-1(3,4)5/h2-5,9,12H,6-7H2,1H3;(H,2,3,4,5)/q+1;/p-1