(E)-5-(4-methoxyphenyl)-2-nitro-3-oxidanylidene-pent-4-enoic acid

Systemtic Name: (E)-5-(4-methoxyphenyl)-2-nitro-3-oxidanylidene-pent-4-enoic acid Openeye Name: (E)-5-(4-methoxyphenyl)-2-nitro-3-oxo-pent-4-enoic acid CAS Name: (E)-5-(4-methoxyphenyl)-2-nitro-3-oxo-4-pentenoic acid IUPAC Name: (E)-5-(4-methoxyphenyl)-2-nitro-3-oxopent-4-enoic acid Traditional Name: (E)-3-keto-5-(4-methoxyphenyl)-2-nitro-pent-4-enoic acid Formula: C12H11NO6 MolecularWeight: 265.21884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)C(C(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)C(C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H11NO6/c1-19-9-5-2-8(3-6-9)4-7-10(14)11(12(15)16)13(17)18/h2-7,11H,1H3,(H,15,16)/b7-4+