zinc 5,15-diphenyl-10-[4-(trifluoromethyl)phenyl]porphyrin-22,24-diide

Systemtic Name: zinc 5,15-diphenyl-10-[4-(trifluoromethyl)phenyl]porphyrin-22,24-diide Openeye Name: zinc 5,15-diphenyl-10-[4-(trifluoromethyl)phenyl]porphyrin-22,24-diide CAS Name: zinc 5,15-diphenyl-10-[4-(trifluoromethyl)phenyl]porphyrin-22,24-diide IUPAC Name: zinc 5,15-diphenyl-10-[4-(trifluoromethyl)phenyl]porphyrin-22,24-diide Traditional Name: zinc 5,15-diphenyl-10-[4-(trifluoromethyl)phenyl]porphine-22,24-diide Formula: C39H23F3N4Zn MolecularWeight: 670.03093

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC(=CC4=NC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C7=CC=C(C=C7)C(F)(F)F)C8=CC=CC=C8)C=C4)[N-]3.[Zn+2]

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC(=CC4=NC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C7=CC=C(C=C7)C(F)(F)F)C8=CC=CC=C8)C=C4)[N-]3.[Zn+2]

InChI

InChI=1S/C39H23F3N4.Zn/c40-39(41,42)27-13-11-26(12-14-27)38-34-21-19-32(45-34)36(24-7-3-1-4-8-24)30-17-15-28(43-30)23-29-16-18-31(44-29)37(25-9-5-2-6-10-25)33-20-22-35(38)46-33;/h1-23H;/q-2;+2