4-[(E)-2-cyano-3-(2-methoxyethoxy)-3-oxidanylidene-prop-1-enyl]-2-methoxy-6-nitro-phenolate

Systemtic Name: 4-[(E)-2-cyano-3-(2-methoxyethoxy)-3-oxidanylidene-prop-1-enyl]-2-methoxy-6-nitro-phenolate Openeye Name: 4-[(E)-2-cyano-3-(2-methoxyethoxy)-3-oxo-prop-1-enyl]-2-methoxy-6-nitro-phenolate CAS Name: 4-[(E)-2-cyano-3-(2-methoxyethoxy)-3-oxoprop-1-enyl]-2-methoxy-6-nitrophenolate IUPAC Name: 4-[(E)-2-cyano-3-(2-methoxyethoxy)-3-oxoprop-1-enyl]-2-methoxy-6-nitrophenolate Traditional Name: 4-[(E)-2-cyano-3-keto-3-(2-methoxyethoxy)prop-1-enyl]-2-methoxy-6-nitro-phenolate Formula: C14H13N2O7- MolecularWeight: 321.26222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N2O7/c1-21-3-4-23-14(18)10(8-15)5-9-6-11(16(19)20)13(17)12(7-9)22-2/h5-7,17H,3-4H2,1-2H3/p-1/b10-5+