zinc 10-(4-methylphenyl)-15-(2,4,6-trimethylphenyl)spiro[2H-porphyrin-22,23-diide-3,1'-cyclohexane]

Systemtic Name: zinc 10-(4-methylphenyl)-15-(2,4,6-trimethylphenyl)spiro[2H-porphyrin-22,23-diide-3,1'-cyclohexane] Openeye Name: zinc 10-(p-tolyl)-15-(2,4,6-trimethylphenyl)spiro[2H-porphyrin-22,23-diide-3,1'-cyclohexane] CAS Name: zinc 10-(4-methylphenyl)-15-(2,4,6-trimethylphenyl)spiro[2H-porphyrin-22,23-diide-3,1'-cyclohexane] IUPAC Name: zinc 10-(4-methylphenyl)-15-(2,4,6-trimethylphenyl)spiro[2H-porphyrin-22,23-diide-3,1'-cyclohexane] Traditional Name: zinc 15-mesityl-10-(p-tolyl)spiro[2H-porphine-22,23-diide-3,1'-cyclohexane] Formula: C41H38N4Zn MolecularWeight: 652.17622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3C=CC(=CC4=NC(=CC5=NC(=C(C6=CC=C2[N-]6)C7=C(C=C(C=C7C)C)C)C=C5)CC48CCCCC8)[N-]3.[Zn+2]

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3C=CC(=CC4=NC(=CC5=NC(=C(C6=CC=C2[N-]6)C7=C(C=C(C=C7C)C)C)C=C5)CC48CCCCC8)[N-]3.[Zn+2]

InChI

InChI=1S/C41H38N4.Zn/c1-25-8-10-29(11-9-25)39-33-14-13-31(43-33)23-37-41(18-6-5-7-19-41)24-32(44-37)22-30-12-15-35(42-30)40(36-17-16-34(39)45-36)38-27(3)20-26(2)21-28(38)4;/h8-17,20-23H,5-7,18-19,24H2,1-4H3;/q-2;+2