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

Systemtic Name: 5,10,15,20-tetrakis(3-nitrophenyl)-21,22-dihydroporphyrin Openeye Name: 5,10,15,20-tetrakis(3-nitrophenyl)-21,22-dihydroporphyrin CAS Name: 5,10,15,20-tetrakis(3-nitrophenyl)-21,22-dihydroporphyrin IUPAC Name: 5,10,15,20-tetrakis(3-nitrophenyl)-21,22-dihydroporphyrin Traditional Name: 5,10,15,20-tetrakis(3-nitrophenyl)-21,22-dihydroporphine Formula: C44H26N8O8 MolecularWeight: 794.72604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C44H26N8O8/c53-49(54)29-9-1-5-25(21-29)41-33-13-15-35(45-33)42(26-6-2-10-30(22-26)50(55)56)37-17-19-39(47-37)44(28-8-4-12-32(24-28)52(59)60)40-20-18-38(48-40)43(36-16-14-34(41)46-36)27-7-3-11-31(23-27)51(57)58/h1-24,45-46H