5,15-bis(1-methylpyridin-1-ium-4-yl)-21,22-dihydroporphyrin

Systemtic Name: 5,15-bis(1-methylpyridin-1-ium-4-yl)-21,22-dihydroporphyrin Openeye Name: 5,15-bis(1-methylpyridin-1-ium-4-yl)-21,22-dihydroporphyrin CAS Name: 5,15-bis(1-methyl-4-pyridin-1-iumyl)-21,22-dihydroporphyrin IUPAC Name: 5,15-bis(1-methylpyridin-1-ium-4-yl)-21,22-dihydroporphyrin Traditional Name: 5,15-bis(1-methylpyridin-1-ium-4-yl)-21,22-dihydroporphine Formula: C32H26N6+2 MolecularWeight: 494.58904

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C2=C3C=CC(=CC4=NC(=C(C5=NC(=CC6=CC=C2N6)C=C5)C7=CC=[N+](C=C7)C)C=C4)N3

Isomeric SMILES

C[N+]1=CC=C(C=C1)C2=C3C=CC(=CC4=NC(=C(C5=NC(=CC6=CC=C2N6)C=C5)C7=CC=[N+](C=C7)C)C=C4)N3

InChI

InChI=1S/C32H25N6/c1-37-15-11-21(12-16-37)31-27-7-3-23(33-27)19-25-5-9-29(35-25)32(22-13-17-38(2)18-14-22)30-10-6-26(36-30)20-24-4-8-28(31)34-24/h3-20H,1-2H3,(H,33,34,35,36)/q+1/p+1