(1E,10Z,14E)-5,15,19,20-tetraphenyl-22,23-dihydro-21H-porphyrin

Systemtic Name: (1E,10Z,14E)-5,15,19,20-tetraphenyl-22,23-dihydro-21H-porphyrin Openeye Name: (1E,10Z,14E)-5,15,19,20-tetraphenyl-22,23-dihydro-21H-porphyrin CAS Name: (1E,10Z,14E)-5,15,19,20-tetraphenyl-22,23-dihydro-21H-porphyrin IUPAC Name: (1E,10Z,14E)-5,15,19,20-tetraphenyl-22,23-dihydro-21H-porphyrin Traditional Name: (1E,10Z,14E)-5,15,19,20-tetraphenyl-22,23-dihydro-21H-porphine Formula: C44H32N4 MolecularWeight: 616.75168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC(=CC4=CC=C(N4)C(=C5C=CC(=C(C6(C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)N5)C9=CC=CC=C9)N3

Isomeric SMILES

C1=CC=C(C=C1)/C/2=C\3/C=C/C(=C/C4=CC=C(N4)C(=C5C=C/C(=C(\C6(C=CC2=N6)C7=CC=CC=C7)/C8=CC=CC=C8)/N5)C9=CC=CC=C9)/N3

InChI

InChI=1S/C44H32N4/c1-5-13-30(14-6-1)41-36-23-21-34(45-36)29-35-22-24-37(46-35)42(31-15-7-2-8-16-31)39-27-28-44(48-39,33-19-11-4-12-20-33)43(32-17-9-3-10-18-32)40-26-25-38(41)47-40/h1-29,45-47H/b35-29-,41-38?,42-37+,43-40+