5,10,15,20-tetraphenyl-21,23-dihydroporphyrin-2,12-dicarbaldehyde

Systemtic Name: 5,10,15,20-tetraphenyl-21,23-dihydroporphyrin-2,12-dicarbaldehyde Openeye Name: 5,10,15,20-tetraphenyl-21,23-dihydroporphyrin-2,12-dicarbaldehyde CAS Name: 5,10,15,20-tetraphenyl-21,23-dihydroporphyrin-2,12-dicarboxaldehyde IUPAC Name: 5,10,15,20-tetraphenyl-21,23-dihydroporphyrin-2,12-dicarbaldehyde Traditional Name: 5,10,15,20-tetraphenyl-21,23-dihydroporphine-2,12-dicarbaldehyde Formula: C46H30N4O2 MolecularWeight: 670.756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC(=N3)C(=C4C(=CC(=C(C5=NC(=C(C6=C(C=C2N6)C=O)C7=CC=CC=C7)C=C5)C8=CC=CC=C8)N4)C=O)C9=CC=CC=C9

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC(=N3)C(=C4C(=CC(=C(C5=NC(=C(C6=C(C=C2N6)C=O)C7=CC=CC=C7)C=C5)C8=CC=CC=C8)N4)C=O)C9=CC=CC=C9

InChI

InChI=1S/C46H30N4O2/c51-27-33-25-39-41(29-13-5-1-6-14-29)35-21-23-37(47-35)43(31-17-9-3-10-18-31)46-34(28-52)26-40(50-46)42(30-15-7-2-8-16-30)36-22-24-38(48-36)44(45(33)49-39)32-19-11-4-12-20-32/h1-28,49-50H