10,15,20-triphenyl-21,22-dihydroporphyrin-5-carbonitrile

Systemtic Name: 10,15,20-triphenyl-21,22-dihydroporphyrin-5-carbonitrile Openeye Name: 10,15,20-triphenyl-21,22-dihydroporphyrin-5-carbonitrile CAS Name: 10,15,20-triphenyl-21,22-dihydroporphyrin-5-carbonitrile IUPAC Name: 10,15,20-triphenyl-21,22-dihydroporphyrin-5-carbonitrile Traditional Name: 10,15,20-triphenyl-21,22-dihydroporphine-5-carbonitrile Formula: C39H25N5 MolecularWeight: 563.6493

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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=CC(=N5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)C#N)N3

Isomeric SMILES

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

InChI

InChI=1S/C39H25N5/c40-24-28-29-16-18-31(41-29)37(25-10-4-1-5-11-25)33-20-22-35(43-33)39(27-14-8-3-9-15-27)36-23-21-34(44-36)38(26-12-6-2-7-13-26)32-19-17-30(28)42-32/h1-23,41-42H