2-(1H-benzimidazol-2-yl)quinoline; 2,4,6-trinitrophenol

Systemtic Name: 2-(1H-benzimidazol-2-yl)quinoline; 2,4,6-trinitrophenol Openeye Name: 2-(1H-benzimidazol-2-yl)quinoline; picric acid CAS Name: 2-(1H-benzimidazol-2-yl)quinoline; 2,4,6-trinitrophenol IUPAC Name: 2-(1H-benzimidazol-2-yl)quinoline; 2,4,6-trinitrophenol Traditional Name: 2-(1H-benzimidazol-2-yl)quinoline; picric acid Formula: C22H14N6O7 MolecularWeight: 474.38256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C3=NC4=CC=CC=C4N3.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C3=NC4=CC=CC=C4N3.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H11N3.C6H3N3O7/c1-2-6-12-11(5-1)9-10-15(17-12)16-18-13-7-3-4-8-14(13)19-16;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-10H,(H,18,19);1-2,10H