2,17,18,20-tetrakis(2,4-dichlorophenyl)-21,22-dihydroporphyrin

Systemtic Name: 2,17,18,20-tetrakis(2,4-dichlorophenyl)-21,22-dihydroporphyrin Openeye Name: 2,17,18,20-tetrakis(2,4-dichlorophenyl)-21,22-dihydroporphyrin CAS Name: 2,17,18,20-tetrakis(2,4-dichlorophenyl)-21,22-dihydroporphyrin IUPAC Name: 2,17,18,20-tetrakis(2,4-dichlorophenyl)-21,22-dihydroporphyrin Traditional Name: 2,17,18,20-tetrakis(2,4-dichlorophenyl)-21,22-dihydroporphine Formula: C44H22Cl8N4 MolecularWeight: 890.29628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC3=CC(=C(N3)C(=C4C(=C(C(=N4)C=C5C=CC(=N5)C=C1N2)C6=C(C=C(C=C6)Cl)Cl)C7=C(C=C(C=C7)Cl)Cl)C8=C(C=C(C=C8)Cl)Cl)C9=C(C=C(C=C9)Cl)Cl

Isomeric SMILES

C1=CC2=CC3=CC(=C(N3)C(=C4C(=C(C(=N4)C=C5C=CC(=N5)C=C1N2)C6=C(C=C(C=C6)Cl)Cl)C7=C(C=C(C=C7)Cl)Cl)C8=C(C=C(C=C8)Cl)Cl)C9=C(C=C(C=C9)Cl)Cl

InChI

InChI=1S/C44H22Cl8N4/c45-21-1-9-30(35(49)13-21)34-19-29-18-27-6-5-25(53-27)17-26-7-8-28(54-26)20-39-40(31-10-2-22(46)14-36(31)50)41(32-11-3-23(47)15-37(32)51)44(56-39)42(43(34)55-29)33-12-4-24(48)16-38(33)52/h1-20,53,55H