ethyl (5Z)-5-[ethoxy(oxidanyl)methylidene]-2-methyl-6-(3-nitrophenyl)-2-oxidanyl-4-oxidanylidene-cyclohexane-1-carboxylate

Systemtic Name: ethyl (5Z)-5-[ethoxy(oxidanyl)methylidene]-2-methyl-6-(3-nitrophenyl)-2-oxidanyl-4-oxidanylidene-cyclohexane-1-carboxylate Openeye Name: ethyl (5Z)-5-[ethoxy(hydroxy)methylene]-2-hydroxy-2-methyl-6-(3-nitrophenyl)-4-oxo-cyclohexanecarboxylate CAS Name: (5Z)-5-[ethoxy(hydroxy)methylidene]-2-hydroxy-2-methyl-6-(3-nitrophenyl)-4-oxo-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl (5Z)-5-[ethoxy(hydroxy)methylidene]-2-hydroxy-2-methyl-6-(3-nitrophenyl)-4-oxocyclohexane-1-carboxylate Traditional Name: (5Z)-5-[ethoxy(hydroxy)methylene]-2-hydroxy-4-keto-2-methyl-6-(3-nitrophenyl)cyclohexanecarboxylic acid ethyl ester Formula: C19H23NO8 MolecularWeight: 393.38782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(=C(O)OCC)C(=O)CC1(C)O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1C(/C(=C(\O)/OCC)/C(=O)CC1(C)O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H23NO8/c1-4-27-17(22)15-13(21)10-19(3,24)16(18(23)28-5-2)14(15)11-7-6-8-12(9-11)20(25)26/h6-9,14,16,22,24H,4-5,10H2,1-3H3/b17-15+