3,4-dinitro-5-phenyl-benzene-1,2-diol

Systemtic Name: 3,4-dinitro-5-phenyl-benzene-1,2-diol Openeye Name: 3,4-dinitro-5-phenyl-benzene-1,2-diol CAS Name: 3,4-dinitro-5-phenylbenzene-1,2-diol IUPAC Name: 3,4-dinitro-5-phenylbenzene-1,2-diol Traditional Name: 3,4-dinitro-5-phenyl-pyrocatechol Formula: C12H8N2O6 MolecularWeight: 276.20172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H8N2O6/c15-9-6-8(7-4-2-1-3-5-7)10(13(17)18)11(12(9)16)14(19)20/h1-6,15-16H