[4-[(dimethylazaniumyl)methyl]-5-oxidanyl-6-phenethyl-pyridin-2-yl]methyl-dimethyl-azanium

Systemtic Name: [4-[(dimethylazaniumyl)methyl]-5-oxidanyl-6-phenethyl-pyridin-2-yl]methyl-dimethyl-azanium Openeye Name: [4-[(dimethylammonio)methyl]-5-hydroxy-6-phenethyl-2-pyridyl]methyl-dimethyl-ammonium CAS Name: [4-[(dimethylammonio)methyl]-5-hydroxy-6-phenethyl-2-pyridinyl]methyl-dimethylammonium IUPAC Name: [4-[(dimethylazaniumyl)methyl]-5-hydroxy-6-phenethylpyridin-2-yl]methyl-dimethylazanium Traditional Name: [4-[(dimethylammonio)methyl]-5-hydroxy-6-phenethyl-2-pyridyl]methyl-dimethyl-ammonium Formula: C19H29N3O+2 MolecularWeight: 315.45306

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC(=NC(=C1O)CCC2=CC=CC=C2)C[NH+](C)C

Isomeric SMILES

C[NH+](C)CC1=CC(=NC(=C1O)CCC2=CC=CC=C2)C[NH+](C)C

InChI

InChI=1S/C19H27N3O/c1-21(2)13-16-12-17(14-22(3)4)20-18(19(16)23)11-10-15-8-6-5-7-9-15/h5-9,12,23H,10-11,13-14H2,1-4H3/p+2