(4-phenylcyclopenta-1,3-dien-1-yl)benzene; 2,4,6-trinitrophenol

Systemtic Name: (4-phenylcyclopenta-1,3-dien-1-yl)benzene; 2,4,6-trinitrophenol Openeye Name: (4-phenylcyclopenta-1,3-dien-1-yl)benzene; picric acid CAS Name: (4-phenyl-1-cyclopenta-1,3-dienyl)benzene; 2,4,6-trinitrophenol IUPAC Name: (4-phenylcyclopenta-1,3-dien-1-yl)benzene; 2,4,6-trinitrophenol Traditional Name: (4-phenylcyclopenta-1,3-dien-1-yl)benzene; picric acid Formula: C23H17N3O7 MolecularWeight: 447.39698

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC=C1C2=CC=CC=C2)C3=CC=CC=C3.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1C(=CC=C1C2=CC=CC=C2)C3=CC=CC=C3.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H14.C6H3N3O7/c1-3-7-14(8-4-1)16-11-12-17(13-16)15-9-5-2-6-10-15;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-12H,13H2;1-2,10H