methyl (3E)-3-[1-(oxidanylamino)butylidene]-4-oxidanylidene-cyclohexa-1,5-diene-1-carboxylate

Systemtic Name: methyl (3E)-3-[1-(oxidanylamino)butylidene]-4-oxidanylidene-cyclohexa-1,5-diene-1-carboxylate Openeye Name: methyl (3E)-3-[1-(hydroxyamino)butylidene]-4-oxo-cyclohexa-1,5-diene-1-carboxylate CAS Name: (3E)-3-[1-(hydroxyamino)butylidene]-4-oxo-1-cyclohexa-1,5-dienecarboxylic acid methyl ester IUPAC Name: methyl (3E)-3-[1-(hydroxyamino)butylidene]-4-oxocyclohexa-1,5-diene-1-carboxylate Traditional Name: (3E)-3-[1-(hydroxyamino)butylidene]-4-keto-cyclohexa-1,5-diene-1-carboxylic acid methyl ester Formula: C12H15NO4 MolecularWeight: 237.2518

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C1C=C(C=CC1=O)C(=O)OC)NO

Isomeric SMILES

CCC/C(=C\1/C=C(C=CC1=O)C(=O)OC)/NO

InChI

InChI=1S/C12H15NO4/c1-3-4-10(13-16)9-7-8(12(15)17-2)5-6-11(9)14/h5-7,13,16H,3-4H2,1-2H3/b10-9+