4-[(3-cyano-4,5-dimethyl-furan-2-yl)iminomethyl]-6-nitro-benzene-1,3-diolate

Systemtic Name: 4-[(3-cyano-4,5-dimethyl-furan-2-yl)iminomethyl]-6-nitro-benzene-1,3-diolate Openeye Name: 4-[(3-cyano-4,5-dimethyl-2-furyl)iminomethyl]-6-nitro-benzene-1,3-diolate CAS Name: 4-[(3-cyano-4,5-dimethyl-2-furanyl)iminomethyl]-6-nitrobenzene-1,3-diolate IUPAC Name: 4-[(3-cyano-4,5-dimethylfuran-2-yl)iminomethyl]-6-nitrobenzene-1,3-diolate Traditional Name: 4-[(3-cyano-4,5-dimethyl-2-furyl)iminomethyl]-6-nitro-benzene-1,3-diolate Formula: C14H9N3O5-2 MolecularWeight: 299.23836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1C#N)N=CC2=CC(=C(C=C2[O-])[O-])[N+](=O)[O-])C

Isomeric SMILES

CC1=C(OC(=C1C#N)N=CC2=CC(=C(C=C2[O-])[O-])[N+](=O)[O-])C

InChI

InChI=1S/C14H11N3O5/c1-7-8(2)22-14(10(7)5-15)16-6-9-3-11(17(20)21)13(19)4-12(9)18/h3-4,6,18-19H,1-2H3/p-2