3-methoxy-5,10,15,20-tetraphenyl-22,23-dihydro-3H-porphyrin-2-one

Systemtic Name: 3-methoxy-5,10,15,20-tetraphenyl-22,23-dihydro-3H-porphyrin-2-one Openeye Name: 3-methoxy-5,10,15,20-tetraphenyl-22,23-dihydro-3H-porphyrin-2-one CAS Name: 3-methoxy-5,10,15,20-tetraphenyl-22,23-dihydro-3H-porphyrin-2-one IUPAC Name: 3-methoxy-5,10,15,20-tetraphenyl-22,23-dihydro-3H-porphyrin-2-one Traditional Name: 3-methoxy-5,10,15,20-tetraphenyl-22,23-dihydro-3H-porphin-2-one Formula: C45H32N4O2 MolecularWeight: 660.76118

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Descriptors Computed from Structure

Canonical SMILES:

COC1C2=C(C3=CC=C(N3)C(=C4C=CC(=C(C5=NC(=C(C(=N2)C1=O)C6=CC=CC=C6)C=C5)C7=CC=CC=C7)N4)C8=CC=CC=C8)C9=CC=CC=C9

Isomeric SMILES

COC1C2=C(C3=CC=C(N3)C(=C4C=CC(=C(C5=NC(=C(C(=N2)C1=O)C6=CC=CC=C6)C=C5)C7=CC=CC=C7)N4)C8=CC=CC=C8)C9=CC=CC=C9

InChI

InChI=1S/C45H32N4O2/c1-51-45-43-41(31-20-12-5-13-21-31)37-27-25-35(48-37)39(29-16-8-3-9-17-29)33-23-22-32(46-33)38(28-14-6-2-7-15-28)34-24-26-36(47-34)40(42(49-43)44(45)50)30-18-10-4-11-19-30/h2-27,45-46,48H,1H3