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

Systemtic Name: 5-(3-nitrophenyl)-10,15,20-tripyridin-4-yl-21,22-dihydroporphyrin Openeye Name: 5-(3-nitrophenyl)-10,15,20-tris(4-pyridyl)-21,22-dihydroporphyrin CAS Name: 5-(3-nitrophenyl)-10,15,20-tripyridin-4-yl-21,22-dihydroporphyrin IUPAC Name: 5-(3-nitrophenyl)-10,15,20-tripyridin-4-yl-21,22-dihydroporphyrin Traditional Name: 5-(3-nitrophenyl)-10,15,20-tris(4-pyridyl)-21,22-dihydroporphine Formula: C41H26N8O2 MolecularWeight: 662.69754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=C3C=CC(=C(C4=NC(=C(C5=NC(=C(C6=CC=C2N6)C7=CC=NC=C7)C=C5)C8=CC=NC=C8)C=C4)C9=CC=NC=C9)N3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=C3C=CC(=C(C4=NC(=C(C5=NC(=C(C6=CC=C2N6)C7=CC=NC=C7)C=C5)C8=CC=NC=C8)C=C4)C9=CC=NC=C9)N3

InChI

InChI=1S/C41H26N8O2/c50-49(51)29-3-1-2-28(24-29)41-36-10-8-34(47-36)39(26-14-20-43-21-15-26)32-6-4-30(45-32)38(25-12-18-42-19-13-25)31-5-7-33(46-31)40(27-16-22-44-23-17-27)35-9-11-37(41)48-35/h1-24,47-48H