1-[2-[2-(4-methoxyphenyl)-1,3-dioxolan-2-yl]ethyl]-4-methyl-pyridin-1-ium chloride

Systemtic Name: 1-[2-[2-(4-methoxyphenyl)-1,3-dioxolan-2-yl]ethyl]-4-methyl-pyridin-1-ium chloride Openeye Name: 1-[2-[2-(4-methoxyphenyl)-1,3-dioxolan-2-yl]ethyl]-4-methyl-pyridin-1-ium chloride CAS Name: 1-[2-[2-(4-methoxyphenyl)-1,3-dioxolan-2-yl]ethyl]-4-methylpyridin-1-ium chloride IUPAC Name: 1-[2-[2-(4-methoxyphenyl)-1,3-dioxolan-2-yl]ethyl]-4-methylpyridin-1-ium chloride Traditional Name: 1-[2-[2-(4-methoxyphenyl)-1,3-dioxolan-2-yl]ethyl]-4-methyl-pyridin-1-ium chloride Formula: C18H22ClNO3 MolecularWeight: 335.82518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[N+](C=C1)CCC2(OCCO2)C3=CC=C(C=C3)OC.[Cl-]

Isomeric SMILES

CC1=CC=[N+](C=C1)CCC2(OCCO2)C3=CC=C(C=C3)OC.[Cl-]

InChI

InChI=1S/C18H22NO3.ClH/c1-15-7-10-19(11-8-15)12-9-18(21-13-14-22-18)16-3-5-17(20-2)6-4-16;/h3-8,10-11H,9,12-14H2,1-2H3;1H/q+1;/p-1