4-[(E)-2-cyano-3-oxidanylidene-3-prop-2-enoxy-prop-1-enyl]-2-nitro-phenolate

Systemtic Name: 4-[(E)-2-cyano-3-oxidanylidene-3-prop-2-enoxy-prop-1-enyl]-2-nitro-phenolate Openeye Name: 4-[(E)-3-allyloxy-2-cyano-3-oxo-prop-1-enyl]-2-nitro-phenolate CAS Name: 4-[(E)-2-cyano-3-oxo-3-prop-2-enoxyprop-1-enyl]-2-nitrophenolate IUPAC Name: 4-[(E)-2-cyano-3-oxo-3-prop-2-enoxyprop-1-enyl]-2-nitrophenolate Traditional Name: 4-[(E)-3-allyloxy-2-cyano-3-keto-prop-1-enyl]-2-nitro-phenolate Formula: C13H9N2O5- MolecularWeight: 273.22096

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C(=CC1=CC(=C(C=C1)[O-])[N+](=O)[O-])C#N

Isomeric SMILES

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

InChI

InChI=1S/C13H10N2O5/c1-2-5-20-13(17)10(8-14)6-9-3-4-12(16)11(7-9)15(18)19/h2-4,6-7,16H,1,5H2/p-1/b10-6+