1-[2,3,5,6-tetrakis(4-azanylpyridin-1-ium-1-yl)pyridin-4-yl]pyridin-1-ium-4-amine

Systemtic Name: 1-[2,3,5,6-tetrakis(4-azanylpyridin-1-ium-1-yl)pyridin-4-yl]pyridin-1-ium-4-amine Openeye Name: 1-[2,3,5,6-tetrakis(4-aminopyridin-1-ium-1-yl)-4-pyridyl]pyridin-1-ium-4-amine CAS Name: 1-[2,3,5,6-tetrakis(4-amino-1-pyridin-1-iumyl)-4-pyridinyl]-4-pyridin-1-iumamine IUPAC Name: 1-[2,3,5,6-tetrakis(4-aminopyridin-1-ium-1-yl)pyridin-4-yl]pyridin-1-ium-4-amine Traditional Name: [1-[2,3,5,6-tetrakis(4-aminopyridin-1-ium-1-yl)-4-pyridyl]pyridin-1-ium-4-yl]amine Formula: C30H30N11+5 MolecularWeight: 544.6329

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Descriptors Computed from Structure

Canonical SMILES:

C1=C[N+](=CC=C1N)C2=C(C(=NC(=C2[N+]3=CC=C(C=C3)N)[N+]4=CC=C(C=C4)N)[N+]5=CC=C(C=C5)N)[N+]6=CC=C(C=C6)N

Isomeric SMILES

C1=C[N+](=CC=C1N)C2=C(C(=NC(=C2[N+]3=CC=C(C=C3)N)[N+]4=CC=C(C=C4)N)[N+]5=CC=C(C=C5)N)[N+]6=CC=C(C=C6)N

InChI

InChI=1S/C30H25N11/c31-21-1-11-37(12-2-21)26-27(38-13-3-22(32)4-14-38)29(40-17-7-24(34)8-18-40)36-30(41-19-9-25(35)10-20-41)28(26)39-15-5-23(33)6-16-39/h1-20,31-35H/p+5