[2-[2-(3,4-dimethoxyphenyl)ethyl]-6-methyl-3-oxidanyl-pyridin-1-ium-4-yl]methyl-dimethyl-azanium

Systemtic Name: [2-[2-(3,4-dimethoxyphenyl)ethyl]-6-methyl-3-oxidanyl-pyridin-1-ium-4-yl]methyl-dimethyl-azanium Openeye Name: [2-[2-(3,4-dimethoxyphenyl)ethyl]-3-hydroxy-6-methyl-pyridin-1-ium-4-yl]methyl-dimethyl-ammonium CAS Name: [2-[2-(3,4-dimethoxyphenyl)ethyl]-3-hydroxy-6-methyl-4-pyridin-1-iumyl]methyl-dimethylammonium IUPAC Name: [2-[2-(3,4-dimethoxyphenyl)ethyl]-3-hydroxy-6-methylpyridin-1-ium-4-yl]methyl-dimethylazanium Traditional Name: (2-homoveratryl-3-hydroxy-6-methyl-pyridin-1-ium-4-yl)methyl-dimethyl-ammonium Formula: C19H28N2O3+2 MolecularWeight: 332.43722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C(=C(C(=C1)C[NH+](C)C)O)CCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC1=[NH+]C(=C(C(=C1)C[NH+](C)C)O)CCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C19H26N2O3/c1-13-10-15(12-21(2)3)19(22)16(20-13)8-6-14-7-9-17(23-4)18(11-14)24-5/h7,9-11,22H,6,8,12H2,1-5H3/p+2