zinc 15-[4-(ethoxymethyl)phenyl]-5,10,20-triphenyl-21,22-dihydroporphyrin

Systemtic Name: zinc 15-[4-(ethoxymethyl)phenyl]-5,10,20-triphenyl-21,22-dihydroporphyrin Openeye Name: zinc 15-[4-(ethoxymethyl)phenyl]-5,10,20-triphenyl-21,22-dihydroporphyrin CAS Name: zinc 15-[4-(ethoxymethyl)phenyl]-5,10,20-triphenyl-21,22-dihydroporphyrin IUPAC Name: zinc 15-[4-(ethoxymethyl)phenyl]-5,10,20-triphenyl-21,22-dihydroporphyrin Traditional Name: zinc 15-[4-(ethoxymethyl)phenyl]-5,10,20-triphenyl-21,22-dihydroporphine Formula: C47H36N4OZn+2 MolecularWeight: 738.22394

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=CC=C(C=C1)C2=C3C=CC(=N3)C(=C4C=CC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)N4)C9=CC=CC=C9.[Zn+2]

Isomeric SMILES

CCOCC1=CC=C(C=C1)C2=C3C=CC(=N3)C(=C4C=CC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)N4)C9=CC=CC=C9.[Zn+2]

InChI

InChI=1S/C47H36N4O.Zn/c1-2-52-30-31-18-20-35(21-19-31)47-42-28-26-40(50-42)45(33-14-8-4-9-15-33)38-24-22-36(48-38)44(32-12-6-3-7-13-32)37-23-25-39(49-37)46(34-16-10-5-11-17-34)41-27-29-43(47)51-41;/h3-29,48-49H,2,30H2,1H3;/q;+2