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

Systemtic Name: 1-[[4-[(2-azanylpyridin-1-ium-1-yl)methyl]phenyl]methyl]pyridin-1-ium-2-amine Openeye Name: 1-[[4-[(2-aminopyridin-1-ium-1-yl)methyl]phenyl]methyl]pyridin-1-ium-2-amine CAS Name: 1-[[4-[(2-amino-1-pyridin-1-iumyl)methyl]phenyl]methyl]-2-pyridin-1-iumamine IUPAC Name: 1-[[4-[(2-aminopyridin-1-ium-1-yl)methyl]phenyl]methyl]pyridin-1-ium-2-amine Traditional Name: [1-[4-[(2-aminopyridin-1-ium-1-yl)methyl]benzyl]pyridin-1-ium-2-yl]amine Formula: C18H20N4+2 MolecularWeight: 292.3782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C(=C1)N)CC2=CC=C(C=C2)C[N+]3=CC=CC=C3N

Isomeric SMILES

C1=CC=[N+](C(=C1)N)CC2=CC=C(C=C2)C[N+]3=CC=CC=C3N

InChI

InChI=1S/C18H18N4/c19-17-5-1-3-11-21(17)13-15-7-9-16(10-8-15)14-22-12-4-2-6-18(22)20/h1-12,19-20H,13-14H2/p+2