5,10,15,20-tetraphenyl-22,23-dihydroporphyrin-2,3-dicarbonitrile

Systemtic Name: 5,10,15,20-tetraphenyl-22,23-dihydroporphyrin-2,3-dicarbonitrile Openeye Name: 5,10,15,20-tetraphenyl-22,23-dihydroporphyrin-2,3-dicarbonitrile CAS Name: 5,10,15,20-tetraphenyl-22,23-dihydroporphyrin-2,3-dicarbonitrile IUPAC Name: 5,10,15,20-tetraphenyl-22,23-dihydroporphyrin-2,3-dicarbonitrile Traditional Name: 5,10,15,20-tetraphenyl-22,23-dihydroporphine-2,3-dicarbonitrile Formula: C46H28N6 MolecularWeight: 664.75472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C46H28N6/c47-27-33-34(28-48)46-44(32-19-11-4-12-20-32)40-26-24-38(51-40)42(30-15-7-2-8-16-30)36-22-21-35(49-36)41(29-13-5-1-6-14-29)37-23-25-39(50-37)43(45(33)52-46)31-17-9-3-10-18-31/h1-26,49-50H