2-bromanyl-5,10,15,20-tetrakis(4-chlorophenyl)-21,22-dihydroporphyrin

Systemtic Name: 2-bromanyl-5,10,15,20-tetrakis(4-chlorophenyl)-21,22-dihydroporphyrin Openeye Name: 2-bromo-5,10,15,20-tetrakis(4-chlorophenyl)-21,22-dihydroporphyrin CAS Name: 2-bromo-5,10,15,20-tetrakis(4-chlorophenyl)-21,22-dihydroporphyrin IUPAC Name: 2-bromo-5,10,15,20-tetrakis(4-chlorophenyl)-21,22-dihydroporphyrin Traditional Name: 2-bromo-5,10,15,20-tetrakis(4-chlorophenyl)-21,22-dihydroporphine Formula: C44H25BrCl4N4 MolecularWeight: 831.4121

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C3C=CC(=C(C4=CC(=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)Cl)C8=CC=C(C=C8)Cl)Br)C9=CC=C(C=C9)Cl)N3)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=C3C=CC(=C(C4=CC(=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)Cl)C8=CC=C(C=C8)Cl)Br)C9=CC=C(C=C9)Cl)N3)Cl

InChI

InChI=1S/C44H25BrCl4N4/c45-32-23-39-42(26-5-13-30(48)14-6-26)37-20-19-35(51-37)40(24-1-9-28(46)10-2-24)33-17-18-34(50-33)41(25-3-11-29(47)12-4-25)36-21-22-38(52-36)43(44(32)53-39)27-7-15-31(49)16-8-27/h1-23,51,53H