12-methoxy-13,15,17,18-tetraphenyl-21,22-dihydroporphyrin

Systemtic Name: 12-methoxy-13,15,17,18-tetraphenyl-21,22-dihydroporphyrin Openeye Name: 12-methoxy-13,15,17,18-tetraphenyl-21,22-dihydroporphyrin CAS Name: 12-methoxy-13,15,17,18-tetraphenyl-21,22-dihydroporphyrin IUPAC Name: 12-methoxy-13,15,17,18-tetraphenyl-21,22-dihydroporphyrin Traditional Name: 12-methoxy-13,15,17,18-tetraphenyl-21,22-dihydroporphine Formula: C45H32N4O MolecularWeight: 644.76178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=NC1=CC3=CC=C(N3)C=C4C=CC(=CC5=NC(=C2C6=CC=CC=C6)C(=C5C7=CC=CC=C7)C8=CC=CC=C8)N4)C9=CC=CC=C9

Isomeric SMILES

COC1=C(C2=NC1=CC3=CC=C(N3)C=C4C=CC(=CC5=NC(=C2C6=CC=CC=C6)C(=C5C7=CC=CC=C7)C8=CC=CC=C8)N4)C9=CC=CC=C9

InChI

InChI=1S/C45H32N4O/c1-50-45-38-28-36-25-23-34(47-36)26-33-22-24-35(46-33)27-37-39(29-14-6-2-7-15-29)40(30-16-8-3-9-17-30)43(48-37)41(31-18-10-4-11-19-31)44(49-38)42(45)32-20-12-5-13-21-32/h2-28,46-47H,1H3