2,3,18,20-tetramethoxy-12,13,15,17-tetraphenyl-21,22-dihydroporphyrin

Systemtic Name: 2,3,18,20-tetramethoxy-12,13,15,17-tetraphenyl-21,22-dihydroporphyrin Openeye Name: 2,3,18,20-tetramethoxy-12,13,15,17-tetraphenyl-21,22-dihydroporphyrin CAS Name: 2,3,18,20-tetramethoxy-12,13,15,17-tetraphenyl-21,22-dihydroporphyrin IUPAC Name: 2,3,18,20-tetramethoxy-12,13,15,17-tetraphenyl-21,22-dihydroporphyrin Traditional Name: 2,3,18,20-tetramethoxy-12,13,15,17-tetraphenyl-21,22-dihydroporphine Formula: C48H38N4O4 MolecularWeight: 734.83972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C=C3C=CC(=CC4=NC(=C(C5=NC(=C(C(=C1OC)N2)OC)C(=C5C6=CC=CC=C6)OC)C7=CC=CC=C7)C(=C4C8=CC=CC=C8)C9=CC=CC=C9)N3

Isomeric SMILES

COC1=C2C=C3C=CC(=CC4=NC(=C(C5=NC(=C(C(=C1OC)N2)OC)C(=C5C6=CC=CC=C6)OC)C7=CC=CC=C7)C(=C4C8=CC=CC=C8)C9=CC=CC=C9)N3

InChI

InChI=1S/C48H38N4O4/c1-53-45-36-28-34-26-25-33(49-34)27-35-37(29-17-9-5-10-18-29)38(30-19-11-6-12-20-30)41(50-35)39(31-21-13-7-14-22-31)42-40(32-23-15-8-16-24-32)46(54-2)43(52-42)47(55-3)44(51-36)48(45)56-4/h5-28,49,51H,1-4H3