1-[[4-[(2-azanylpyridin-1-ium-1-yl)methyl]-2,5-dimethoxy-phenyl]methyl]pyridin-1-ium-2-amine

Systemtic Name: 1-[[4-[(2-azanylpyridin-1-ium-1-yl)methyl]-2,5-dimethoxy-phenyl]methyl]pyridin-1-ium-2-amine Openeye Name: 1-[[4-[(2-aminopyridin-1-ium-1-yl)methyl]-2,5-dimethoxy-phenyl]methyl]pyridin-1-ium-2-amine CAS Name: 1-[[4-[(2-amino-1-pyridin-1-iumyl)methyl]-2,5-dimethoxyphenyl]methyl]-2-pyridin-1-iumamine IUPAC Name: 1-[[4-[(2-aminopyridin-1-ium-1-yl)methyl]-2,5-dimethoxyphenyl]methyl]pyridin-1-ium-2-amine Traditional Name: [1-[4-[(2-aminopyridin-1-ium-1-yl)methyl]-2,5-dimethoxy-benzyl]pyridin-1-ium-2-yl]amine Formula: C20H24N4O2+2 MolecularWeight: 352.43016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C[N+]2=CC=CC=C2N)OC)C[N+]3=CC=CC=C3N

Isomeric SMILES

COC1=CC(=C(C=C1C[N+]2=CC=CC=C2N)OC)C[N+]3=CC=CC=C3N

InChI

InChI=1S/C20H22N4O2/c1-25-17-11-16(14-24-10-6-4-8-20(24)22)18(26-2)12-15(17)13-23-9-5-3-7-19(23)21/h3-12,21-22H,13-14H2,1-2H3/p+2