10,15,20-triphenyl-5-(3,4,5-trimethoxyphenyl)-21,22-dihydroporphyrin

Systemtic Name: 10,15,20-triphenyl-5-(3,4,5-trimethoxyphenyl)-21,22-dihydroporphyrin Openeye Name: 10,15,20-triphenyl-5-(3,4,5-trimethoxyphenyl)-21,22-dihydroporphyrin CAS Name: 10,15,20-triphenyl-5-(3,4,5-trimethoxyphenyl)-21,22-dihydroporphyrin IUPAC Name: 10,15,20-triphenyl-5-(3,4,5-trimethoxyphenyl)-21,22-dihydroporphyrin Traditional Name: 10,15,20-triphenyl-5-(3,4,5-trimethoxyphenyl)-21,22-dihydroporphine Formula: C47H36N4O3 MolecularWeight: 704.81374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C3C=CC(=C(C4=NC(=C(C5=NC(=C(C6=CC=C2N6)C7=CC=CC=C7)C=C5)C8=CC=CC=C8)C=C4)C9=CC=CC=C9)N3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C3C=CC(=C(C4=NC(=C(C5=NC(=C(C6=CC=C2N6)C7=CC=CC=C7)C=C5)C8=CC=CC=C8)C=C4)C9=CC=CC=C9)N3

InChI

InChI=1S/C47H36N4O3/c1-52-41-27-32(28-42(53-2)47(41)54-3)46-39-25-23-37(50-39)44(30-15-9-5-10-16-30)35-21-19-33(48-35)43(29-13-7-4-8-14-29)34-20-22-36(49-34)45(31-17-11-6-12-18-31)38-24-26-40(46)51-38/h4-28,50-51H,1-3H3