2-bromanylpyridine; 21,22-dihydroporphyrin; scandium(3+)

Systemtic Name: 2-bromanylpyridine; 21,22-dihydroporphyrin; scandium(3+) Openeye Name: 2-bromopyridine; 21,22-dihydroporphyrin; scandium(3+) CAS Name: 2-bromopyridine; 21,22-dihydroporphyrin; scandium(3+) IUPAC Name: 2-bromopyridine; 21,22-dihydroporphyrin; scandium(3+) Traditional Name: 2-bromopyridine; 21,22-dihydroporphine; scandium(3+) Formula: C25H18BrN5Sc+3 MolecularWeight: 513.30383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)Br.C1=CC2=CC3=CC=C(N3)C=C4C=CC(=N4)C=C5C=CC(=N5)C=C1N2.[Sc+3]

Isomeric SMILES

C1=CC=NC(=C1)Br.C1=CC2=CC3=CC=C(N3)C=C4C=CC(=N4)C=C5C=CC(=N5)C=C1N2.[Sc+3]

InChI

InChI=1S/C20H14N4.C5H4BrN.Sc/c1-2-14-10-16-5-6-18(23-16)12-20-8-7-19(24-20)11-17-4-3-15(22-17)9-13(1)21-14;6-5-3-1-2-4-7-5;/h1-12,21-22H;1-4H;/q;;+3