dimethyl 10-bromanyl-7,7-dimethyl-15-(2,4,6-trimethylphenyl)-21,24-dihydro-8H-porphyrin-2,12-dicarboxylate

Systemtic Name: dimethyl 10-bromanyl-7,7-dimethyl-15-(2,4,6-trimethylphenyl)-21,24-dihydro-8H-porphyrin-2,12-dicarboxylate Openeye Name: dimethyl 10-bromo-7,7-dimethyl-15-(2,4,6-trimethylphenyl)-21,24-dihydro-8H-porphyrin-2,12-dicarboxylate CAS Name: 10-bromo-7,7-dimethyl-15-(2,4,6-trimethylphenyl)-21,24-dihydro-8H-porphyrin-2,12-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 10-bromo-7,7-dimethyl-15-(2,4,6-trimethylphenyl)-21,24-dihydro-8H-porphyrin-2,12-dicarboxylate Traditional Name: 10-bromo-15-mesityl-7,7-dimethyl-21,24-dihydro-8H-porphine-2,12-dicarboxylic acid dimethyl ester Formula: C35H33BrN4O4 MolecularWeight: 653.56492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C2=C3C=CC(=CC4=C(C=C(N4)C=C5C(CC(=N5)C(=C6C(=CC2=N6)C(=O)OC)Br)(C)C)C(=O)OC)N3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C2=C3C=CC(=CC4=C(C=C(N4)C=C5C(CC(=N5)C(=C6C(=CC2=N6)C(=O)OC)Br)(C)C)C(=O)OC)N3)C

InChI

InChI=1S/C35H33BrN4O4/c1-17-10-18(2)29(19(3)11-17)30-24-9-8-20(37-24)13-25-22(33(41)43-6)12-21(38-25)14-28-35(4,5)16-27(39-28)31(36)32-23(34(42)44-7)15-26(30)40-32/h8-15,37-38H,16H2,1-7H3