5,10-bis(3-nitrophenyl)-15,20-diphenyl-21,22-dihydroporphyrin

Systemtic Name: 5,10-bis(3-nitrophenyl)-15,20-diphenyl-21,22-dihydroporphyrin Openeye Name: 5,10-bis(3-nitrophenyl)-15,20-diphenyl-21,22-dihydroporphyrin CAS Name: 5,10-bis(3-nitrophenyl)-15,20-diphenyl-21,22-dihydroporphyrin IUPAC Name: 5,10-bis(3-nitrophenyl)-15,20-diphenyl-21,22-dihydroporphyrin Traditional Name: 5,10-bis(3-nitrophenyl)-15,20-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=CC=C7)C8=CC(=CC=C8)[N+](=O)[O-])C9=CC(=CC=C9)[N+](=O)[O-])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=CC=C7)C8=CC(=CC=C8)[N+](=O)[O-])C9=CC(=CC=C9)[N+](=O)[O-])N3

InChI

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