10,20-bis(4-iodophenyl)-5,15-bis(2,4,6-trimethylphenyl)-21,22-dihydroporphyrin

Systemtic Name: 10,20-bis(4-iodophenyl)-5,15-bis(2,4,6-trimethylphenyl)-21,22-dihydroporphyrin Openeye Name: 10,20-bis(4-iodophenyl)-5,15-bis(2,4,6-trimethylphenyl)-21,22-dihydroporphyrin CAS Name: 10,20-bis(4-iodophenyl)-5,15-bis(2,4,6-trimethylphenyl)-21,22-dihydroporphyrin IUPAC Name: 10,20-bis(4-iodophenyl)-5,15-bis(2,4,6-trimethylphenyl)-21,22-dihydroporphyrin Traditional Name: 10,20-bis(4-iodophenyl)-5,15-dimesityl-21,22-dihydroporphine Formula: C50H40I2N4 MolecularWeight: 950.68834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C2=C3C=CC(=C(C4=NC(=C(C5=NC(=C(C6=CC=C2N6)C7=CC=C(C=C7)I)C=C5)C8=C(C=C(C=C8C)C)C)C=C4)C9=CC=C(C=C9)I)N3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C2=C3C=CC(=C(C4=NC(=C(C5=NC(=C(C6=CC=C2N6)C7=CC=C(C=C7)I)C=C5)C8=C(C=C(C=C8C)C)C)C=C4)C9=CC=C(C=C9)I)N3)C

InChI

InChI=1S/C50H40I2N4/c1-27-23-29(3)45(30(4)24-27)49-41-19-15-37(53-41)47(33-7-11-35(51)12-8-33)39-17-21-43(55-39)50(46-31(5)25-28(2)26-32(46)6)44-22-18-40(56-44)48(38-16-20-42(49)54-38)34-9-13-36(52)14-10-34/h7-26,53-54H,1-6H3