10,15-bis(4-nitrophenyl)-5,20-diphenyl-21,22-dihydroporphyrin

Systemtic Name: 10,15-bis(4-nitrophenyl)-5,20-diphenyl-21,22-dihydroporphyrin Openeye Name: 10,15-bis(4-nitrophenyl)-5,20-diphenyl-21,22-dihydroporphyrin CAS Name: 10,15-bis(4-nitrophenyl)-5,20-diphenyl-21,22-dihydroporphyrin IUPAC Name: 10,15-bis(4-nitrophenyl)-5,20-diphenyl-21,22-dihydroporphyrin Traditional Name: 10,15-bis(4-nitrophenyl)-5,20-diphenyl-21,22-dihydroporphine Formula: C44H28N6O4 MolecularWeight: 704.73092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)[N+](=O)[O-])C8=CC=C(C=C8)[N+](=O)[O-])C9=CC=CC=C9)N3

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)[N+](=O)[O-])C8=CC=C(C=C8)[N+](=O)[O-])C9=CC=CC=C9)N3

InChI

InChI=1S/C44H28N6O4/c51-49(52)31-15-11-29(12-16-31)43-37-23-21-35(46-37)41(27-7-3-1-4-8-27)33-19-20-34(45-33)42(28-9-5-2-6-10-28)36-22-24-38(47-36)44(40-26-25-39(43)48-40)30-13-17-32(18-14-30)50(53)54/h1-26,45-46H