(E)-2-cyano-3-[3-nitro-4,5-bis(oxidanyl)phenyl]prop-2-enoate

Systemtic Name: (E)-2-cyano-3-[3-nitro-4,5-bis(oxidanyl)phenyl]prop-2-enoate Openeye Name: (E)-2-cyano-3-(3,4-dihydroxy-5-nitro-phenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(3,4-dihydroxy-5-nitrophenyl)-2-propenoate IUPAC Name: (E)-2-cyano-3-(3,4-dihydroxy-5-nitrophenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(3,4-dihydroxy-5-nitro-phenyl)acrylate Formula: C10H5N2O6- MolecularWeight: 249.1565

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1[N+](=O)[O-])O)O)C=C(C#N)C(=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1[N+](=O)[O-])O)O)/C=C(\C#N)/C(=O)[O-]

InChI

InChI=1S/C10H6N2O6/c11-4-6(10(15)16)1-5-2-7(12(17)18)9(14)8(13)3-5/h1-3,13-14H,(H,15,16)/p-1/b6-1+