3-(10,15,20-triphenyl-21,22-dihydroporphyrin-5-yl)benzenediazonium chloride

Systemtic Name: 3-(10,15,20-triphenyl-21,22-dihydroporphyrin-5-yl)benzenediazonium chloride Openeye Name: 3-(10,15,20-triphenyl-21,22-dihydroporphyrin-5-yl)benzenediazonium chloride CAS Name: 3-(10,15,20-triphenyl-21,22-dihydroporphyrin-5-yl)benzenediazonium chloride IUPAC Name: 3-(10,15,20-triphenyl-21,22-dihydroporphyrin-5-yl)benzenediazonium chloride Traditional Name: 3-(10,15,20-triphenyl-21,22-dihydroporphin-5-yl)benzenediazonium chloride Formula: C44H29ClN6 MolecularWeight: 677.19426

Click to see the large picture

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)C9=CC(=CC=C9)[N+]#N)N3.[Cl-]

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)C9=CC(=CC=C9)[N+]#N)N3.[Cl-]

InChI

InChI=1S/C44H28N6.ClH/c45-50-32-18-10-17-31(27-32)44-39-25-23-37(48-39)42(29-13-6-2-7-14-29)35-21-19-33(46-35)41(28-11-4-1-5-12-28)34-20-22-36(47-34)43(30-15-8-3-9-16-30)38-24-26-40(44)49-38;/h1-27,45H;1H