1-[(4-nitrophenoxy)methyl]benzimidazole; 2,4,6-trinitrophenol

Systemtic Name: 1-[(4-nitrophenoxy)methyl]benzimidazole; 2,4,6-trinitrophenol Openeye Name: 1-[(4-nitrophenoxy)methyl]benzimidazole; picric acid CAS Name: 1-[(4-nitrophenoxy)methyl]benzimidazole; 2,4,6-trinitrophenol IUPAC Name: 1-[(4-nitrophenoxy)methyl]benzimidazole; 2,4,6-trinitrophenol Traditional Name: 1-[(4-nitrophenoxy)methyl]benzimidazole; picric acid Formula: C20H14N6O10 MolecularWeight: 498.35936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2COC3=CC=C(C=C3)[N+](=O)[O-].C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2COC3=CC=C(C=C3)[N+](=O)[O-].C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H11N3O3.C6H3N3O7/c18-17(19)11-5-7-12(8-6-11)20-10-16-9-15-13-3-1-2-4-14(13)16;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-9H,10H2;1-2,10H