2-(4,6-diphenylpyrylium-2-yl)pyridine; 2,4,6-trinitrophenolate

Systemtic Name: 2-(4,6-diphenylpyrylium-2-yl)pyridine; 2,4,6-trinitrophenolate Openeye Name: 2-(4,6-diphenylpyrylium-2-yl)pyridine; 2,4,6-trinitrophenolate CAS Name: 2-(4,6-diphenyl-2-pyryliumyl)pyridine; 2,4,6-trinitrophenolate IUPAC Name: 2-(4,6-diphenylpyrylium-2-yl)pyridine; 2,4,6-trinitrophenolate Traditional Name: 2-(4,6-diphenylpyrylium-2-yl)pyridine picrate Formula: C28H18N4O8 MolecularWeight: 538.46452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=[O+]C(=C2)C3=CC=CC=N3)C4=CC=CC=C4.C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=[O+]C(=C2)C3=CC=CC=N3)C4=CC=CC=C4.C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H16NO.C6H3N3O7/c1-3-9-17(10-4-1)19-15-21(18-11-5-2-6-12-18)24-22(16-19)20-13-7-8-14-23-20;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-16H;1-2,10H/q+1;/p-1