2-[1,2-bis(bromanyl)-2-(2-nitrophenyl)ethyl]pyridine; 2,4,6-trinitrophenol

Systemtic Name: 2-[1,2-bis(bromanyl)-2-(2-nitrophenyl)ethyl]pyridine; 2,4,6-trinitrophenol Openeye Name: 2-[1,2-dibromo-2-(2-nitrophenyl)ethyl]pyridine; picric acid CAS Name: 2-[1,2-dibromo-2-(2-nitrophenyl)ethyl]pyridine; 2,4,6-trinitrophenol IUPAC Name: 2-[1,2-dibromo-2-(2-nitrophenyl)ethyl]pyridine; 2,4,6-trinitrophenol Traditional Name: 2-[1,2-dibromo-2-(2-nitrophenyl)ethyl]pyridine; picric acid Formula: C19H13Br2N5O9 MolecularWeight: 615.14262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(C(C2=CC=CC=N2)Br)Br)[N+](=O)[O-].C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(C(C2=CC=CC=N2)Br)Br)[N+](=O)[O-].C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H10Br2N2O2.C6H3N3O7/c14-12(13(15)10-6-3-4-8-16-10)9-5-1-2-7-11(9)17(18)19;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-8,12-13H;1-2,10H