2-[(3,5-dinitro-2-oxidanyl-phenyl)methyl]-4,6-dinitro-phenol

Systemtic Name: 2-[(3,5-dinitro-2-oxidanyl-phenyl)methyl]-4,6-dinitro-phenol Openeye Name: 2-[(2-hydroxy-3,5-dinitro-phenyl)methyl]-4,6-dinitro-phenol CAS Name: 2-[(2-hydroxy-3,5-dinitrophenyl)methyl]-4,6-dinitrophenol IUPAC Name: 2-[(2-hydroxy-3,5-dinitrophenyl)methyl]-4,6-dinitrophenol Traditional Name: 2-(2-hydroxy-3,5-dinitro-benzyl)-4,6-dinitro-phenol Formula: C13H8N4O10 MolecularWeight: 380.22342

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1[N+](=O)[O-])O)CC2=CC(=CC(=C2O)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1[N+](=O)[O-])O)CC2=CC(=CC(=C2O)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H8N4O10/c18-12-6(2-8(14(20)21)4-10(12)16(24)25)1-7-3-9(15(22)23)5-11(13(7)19)17(26)27/h2-5,18-19H,1H2