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

Systemtic Name: 5-(3,4-dimethoxyphenyl)-10,15,20-triphenyl-21,22-dihydroporphyrin Openeye Name: 5-(3,4-dimethoxyphenyl)-10,15,20-triphenyl-21,22-dihydroporphyrin CAS Name: 5-(3,4-dimethoxyphenyl)-10,15,20-triphenyl-21,22-dihydroporphyrin IUPAC Name: 5-(3,4-dimethoxyphenyl)-10,15,20-triphenyl-21,22-dihydroporphyrin Traditional Name: 5-(3,4-dimethoxyphenyl)-10,15,20-triphenyl-21,22-dihydroporphine Formula: C46H34N4O2 MolecularWeight: 674.78776

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)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)OC

Isomeric SMILES

COC1=C(C=C(C=C1)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)OC

InChI

InChI=1S/C46H34N4O2/c1-51-41-27-18-32(28-42(41)52-2)46-39-25-23-37(49-39)44(30-14-8-4-9-15-30)35-21-19-33(47-35)43(29-12-6-3-7-13-29)34-20-22-36(48-34)45(31-16-10-5-11-17-31)38-24-26-40(46)50-38/h3-28,49-50H,1-2H3