bis[3-nitro-4,5-bis(oxidanyl)phenyl]methanone

Systemtic Name: bis[3-nitro-4,5-bis(oxidanyl)phenyl]methanone Openeye Name: bis(3,4-dihydroxy-5-nitro-phenyl)methanone CAS Name: bis(3,4-dihydroxy-5-nitrophenyl)methanone IUPAC Name: bis(3,4-dihydroxy-5-nitrophenyl)methanone Traditional Name: bis(3,4-dihydroxy-5-nitro-phenyl)methanone Formula: C13H8N2O9 MolecularWeight: 336.21062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H8N2O9/c16-9-3-5(1-7(12(9)19)14(21)22)11(18)6-2-8(15(23)24)13(20)10(17)4-6/h1-4,16-17,19-20H