2-methyl-5-[(1-methylpyridin-1-ium-3-yl)methylamino]phenol chloride

Systemtic Name: 2-methyl-5-[(1-methylpyridin-1-ium-3-yl)methylamino]phenol chloride Openeye Name: 2-methyl-5-[(1-methylpyridin-1-ium-3-yl)methylamino]phenol chloride CAS Name: 2-methyl-5-[(1-methyl-3-pyridin-1-iumyl)methylamino]phenol chloride IUPAC Name: 2-methyl-5-[(1-methylpyridin-1-ium-3-yl)methylamino]phenol chloride Traditional Name: 2-methyl-5-[(1-methylpyridin-1-ium-3-yl)methylamino]phenol chloride Formula: C14H17ClN2O MolecularWeight: 264.75058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NCC2=C[N+](=CC=C2)C)O.[Cl-]

Isomeric SMILES

CC1=C(C=C(C=C1)NCC2=C[N+](=CC=C2)C)O.[Cl-]

InChI

InChI=1S/C14H16N2O.ClH/c1-11-5-6-13(8-14(11)17)15-9-12-4-3-7-16(2)10-12;/h3-8,10,15H,9H2,1-2H3;1H