phenanthrene; 2,4,6-trinitrophenol

Systemtic Name: phenanthrene; 2,4,6-trinitrophenol Openeye Name: phenanthrene; picric acid CAS Name: phenanthrene; 2,4,6-trinitrophenol IUPAC Name: phenanthrene; 2,4,6-trinitrophenol Traditional Name: phenanthrene; picric acid Formula: C20H13N3O7 MolecularWeight: 407.33312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=CC=CC=C32.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=CC=CC=C32.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H10.C6H3N3O7/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-10H;1-2,10H