1-[[3-[(4-azanylpyridin-1-ium-1-yl)methyl]quinoxalin-2-yl]methyl]pyridin-1-ium-4-amine

Systemtic Name: 1-[[3-[(4-azanylpyridin-1-ium-1-yl)methyl]quinoxalin-2-yl]methyl]pyridin-1-ium-4-amine Openeye Name: 1-[[3-[(4-aminopyridin-1-ium-1-yl)methyl]quinoxalin-2-yl]methyl]pyridin-1-ium-4-amine CAS Name: 1-[[3-[(4-amino-1-pyridin-1-iumyl)methyl]-2-quinoxalinyl]methyl]-4-pyridin-1-iumamine IUPAC Name: 1-[[3-[(4-aminopyridin-1-ium-1-yl)methyl]quinoxalin-2-yl]methyl]pyridin-1-ium-4-amine Traditional Name: [1-[[3-[(4-aminopyridin-1-ium-1-yl)methyl]quinoxalin-2-yl]methyl]pyridin-1-ium-4-yl]amine Formula: C20H20N6+2 MolecularWeight: 344.413

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(C(=N2)C[N+]3=CC=C(C=C3)N)C[N+]4=CC=C(C=C4)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(C(=N2)C[N+]3=CC=C(C=C3)N)C[N+]4=CC=C(C=C4)N

InChI

InChI=1S/C20H18N6/c21-15-5-9-25(10-6-15)13-19-20(14-26-11-7-16(22)8-12-26)24-18-4-2-1-3-17(18)23-19/h1-12,21-22H,13-14H2/p+2