zinc 8-ethenyl-3,3-dimethyl-15-(2,4,6-trimethylphenyl)-2H-porphyrin-23,24-diide

Systemtic Name: zinc 8-ethenyl-3,3-dimethyl-15-(2,4,6-trimethylphenyl)-2H-porphyrin-23,24-diide Openeye Name: zinc 3,3-dimethyl-15-(2,4,6-trimethylphenyl)-8-vinyl-2H-porphyrin-23,24-diide CAS Name: zinc 8-ethenyl-3,3-dimethyl-15-(2,4,6-trimethylphenyl)-2H-porphyrin-23,24-diide IUPAC Name: zinc 8-ethenyl-3,3-dimethyl-15-(2,4,6-trimethylphenyl)-2H-porphyrin-23,24-diide Traditional Name: zinc 15-mesityl-3,3-dimethyl-8-vinyl-2H-porphine-23,24-diide Formula: C33H30N4Zn MolecularWeight: 548.0271

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C2=C3C=CC(=CC4=NC(=CC5=NC(=CC6=CC=C2[N-]6)CC5(C)C)C=C4C=C)[N-]3)C.[Zn+2]

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C2=C3C=CC(=CC4=NC(=CC5=NC(=CC6=CC=C2[N-]6)CC5(C)C)C=C4C=C)[N-]3)C.[Zn+2]

InChI

InChI=1S/C33H30N4.Zn/c1-7-22-14-25-17-30-33(5,6)18-26(37-30)15-23-8-10-27(34-23)32(31-20(3)12-19(2)13-21(31)4)28-11-9-24(35-28)16-29(22)36-25;/h7-17H,1,18H2,2-6H3;/q-2;+2