10,20-bis(3-nitrophenyl)-5,15-dipyridin-4-yl-21,22-dihydroporphyrin

Systemtic Name: 10,20-bis(3-nitrophenyl)-5,15-dipyridin-4-yl-21,22-dihydroporphyrin Openeye Name: 10,20-bis(3-nitrophenyl)-5,15-bis(4-pyridyl)-21,22-dihydroporphyrin CAS Name: 10,20-bis(3-nitrophenyl)-5,15-dipyridin-4-yl-21,22-dihydroporphyrin IUPAC Name: 10,20-bis(3-nitrophenyl)-5,15-dipyridin-4-yl-21,22-dihydroporphyrin Traditional Name: 10,20-bis(3-nitrophenyl)-5,15-bis(4-pyridyl)-21,22-dihydroporphine Formula: C42H26N8O4 MolecularWeight: 706.70704

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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=NC=C7)C8=CC(=CC=C8)[N+](=O)[O-])C9=CC=NC=C9)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=NC=C7)C8=CC(=CC=C8)[N+](=O)[O-])C9=CC=NC=C9)N3

InChI

InChI=1S/C42H26N8O4/c51-49(52)29-5-1-3-27(23-29)41-35-11-7-31(45-35)39(25-15-19-43-20-16-25)33-9-13-37(47-33)42(28-4-2-6-30(24-28)50(53)54)38-14-10-34(48-38)40(26-17-21-44-22-18-26)32-8-12-36(41)46-32/h1-24,45,47H