2,12-bis(chloranyl)-5,10,15,20-tetraphenyl-21,23-dihydroporphyrin

Systemtic Name: 2,12-bis(chloranyl)-5,10,15,20-tetraphenyl-21,23-dihydroporphyrin Openeye Name: 2,12-dichloro-5,10,15,20-tetraphenyl-21,23-dihydroporphyrin CAS Name: 2,12-dichloro-5,10,15,20-tetraphenyl-21,23-dihydroporphyrin IUPAC Name: 2,12-dichloro-5,10,15,20-tetraphenyl-21,23-dihydroporphyrin Traditional Name: 2,12-dichloro-5,10,15,20-tetraphenyl-21,23-dihydroporphine Formula: C44H28Cl2N4 MolecularWeight: 683.62592

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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)Cl)C7=CC=CC=C7)C=C5)C8=CC=CC=C8)N4)Cl)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)Cl)C7=CC=CC=C7)C=C5)C8=CC=CC=C8)N4)Cl)C9=CC=CC=C9

InChI

InChI=1S/C44H28Cl2N4/c45-31-25-37-39(27-13-5-1-6-14-27)33-21-23-35(47-33)41(29-17-9-3-10-18-29)44-32(46)26-38(50-44)40(28-15-7-2-8-16-28)34-22-24-36(48-34)42(43(31)49-37)30-19-11-4-12-20-30/h1-26,49-50H