5,10,15,20-tetrakis(2,4-dimethoxyphenyl)-21,22-dihydroporphyrin

Systemtic Name: 5,10,15,20-tetrakis(2,4-dimethoxyphenyl)-21,22-dihydroporphyrin Openeye Name: 5,10,15,20-tetrakis(2,4-dimethoxyphenyl)-21,22-dihydroporphyrin CAS Name: 5,10,15,20-tetrakis(2,4-dimethoxyphenyl)-21,22-dihydroporphyrin IUPAC Name: 5,10,15,20-tetrakis(2,4-dimethoxyphenyl)-21,22-dihydroporphyrin Traditional Name: 5,10,15,20-tetrakis(2,4-dimethoxyphenyl)-21,22-dihydroporphine Formula: C52H46N4O8 MolecularWeight: 854.94364

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=C(C=C(C=C7)OC)OC)C8=C(C=C(C=C8)OC)OC)C9=C(C=C(C=C9)OC)OC)N3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=C(C=C(C=C7)OC)OC)C8=C(C=C(C=C8)OC)OC)C9=C(C=C(C=C9)OC)OC)N3)OC

InChI

InChI=1S/C52H46N4O8/c1-57-29-9-13-33(45(25-29)61-5)49-37-17-19-39(53-37)50(34-14-10-30(58-2)26-46(34)62-6)41-21-23-43(55-41)52(36-16-12-32(60-4)28-48(36)64-8)44-24-22-42(56-44)51(40-20-18-38(49)54-40)35-15-11-31(59-3)27-47(35)63-7/h9-28,53-54H,1-8H3