5,10,15,20-tetrakis(3-methylpyridin-2-yl)-21,22-dihydroporphyrin

Systemtic Name: 5,10,15,20-tetrakis(3-methylpyridin-2-yl)-21,22-dihydroporphyrin Openeye Name: 5,10,15,20-tetrakis(3-methyl-2-pyridyl)-21,22-dihydroporphyrin CAS Name: 5,10,15,20-tetrakis(3-methyl-2-pyridinyl)-21,22-dihydroporphyrin IUPAC Name: 5,10,15,20-tetrakis(3-methylpyridin-2-yl)-21,22-dihydroporphyrin Traditional Name: 5,10,15,20-tetrakis(3-methyl-2-pyridyl)-21,22-dihydroporphine Formula: C44H34N8 MolecularWeight: 674.79436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=C(C=CC=N7)C)C8=C(C=CC=N8)C)C9=C(C=CC=N9)C)N3

Isomeric SMILES

CC1=C(N=CC=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=C(C=CC=N7)C)C8=C(C=CC=N8)C)C9=C(C=CC=N9)C)N3

InChI

InChI=1S/C44H34N8/c1-25-9-5-21-45-41(25)37-29-13-15-31(49-29)38(42-26(2)10-6-22-46-42)33-17-19-35(51-33)40(44-28(4)12-8-24-48-44)36-20-18-34(52-36)39(32-16-14-30(37)50-32)43-27(3)11-7-23-47-43/h5-24,49-50H,1-4H3