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

Systemtic Name: 5,10,15,20-tetrakis(3,4,5-trimethoxyphenyl)-21,22-dihydroporphyrin Openeye Name: 5,10,15,20-tetrakis(3,4,5-trimethoxyphenyl)-21,22-dihydroporphyrin CAS Name: 5,10,15,20-tetrakis(3,4,5-trimethoxyphenyl)-21,22-dihydroporphyrin IUPAC Name: 5,10,15,20-tetrakis(3,4,5-trimethoxyphenyl)-21,22-dihydroporphyrin Traditional Name: 5,10,15,20-tetrakis(3,4,5-trimethoxyphenyl)-21,22-dihydroporphine Formula: C56H54N4O12 MolecularWeight: 975.04756

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC(=C(C(=C7)OC)OC)OC)C8=CC(=C(C(=C8)OC)OC)OC)C9=CC(=C(C(=C9)OC)OC)OC)N3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC(=C(C(=C7)OC)OC)OC)C8=CC(=C(C(=C8)OC)OC)OC)C9=CC(=C(C(=C9)OC)OC)OC)N3

InChI

InChI=1S/C56H54N4O12/c1-61-41-21-29(22-42(62-2)53(41)69-9)49-33-13-15-35(57-33)50(30-23-43(63-3)54(70-10)44(24-30)64-4)37-17-19-39(59-37)52(32-27-47(67-7)56(72-12)48(28-32)68-8)40-20-18-38(60-40)51(36-16-14-34(49)58-36)31-25-45(65-5)55(71-11)46(26-31)66-6/h13-28,57-58H,1-12H3