copper 5,10,15-triphenylporphyrin-22,24-diide

Systemtic Name: copper 5,10,15-triphenylporphyrin-22,24-diide Openeye Name: copper 5,10,15-triphenylporphyrin-22,24-diide CAS Name: copper 5,10,15-triphenylporphyrin-22,24-diide IUPAC Name: copper 5,10,15-triphenylporphyrin-22,24-diide Traditional Name: cupric 5,10,15-triphenylporphine-22,24-diide Formula: C38H24CuN4 MolecularWeight: 600.16996

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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=CC=C7)C8=CC=CC=C8)C=C4)[N-]3.[Cu+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=CC=C7)C8=CC=CC=C8)C=C4)[N-]3.[Cu+2]

InChI

InChI=1S/C38H24N4.Cu/c1-4-10-25(11-5-1)36-30-18-16-28(39-30)24-29-17-19-31(40-29)37(26-12-6-2-7-13-26)33-21-23-35(42-33)38(27-14-8-3-9-15-27)34-22-20-32(36)41-34;/h1-24H;/q-2;+2