ethyl (1R,2R,3E)-3-[ethoxy(oxidanyl)methylidene]-4-oxidanylidene-2-phenyl-cyclohexane-1-carboxylate

Systemtic Name: ethyl (1R,2R,3E)-3-[ethoxy(oxidanyl)methylidene]-4-oxidanylidene-2-phenyl-cyclohexane-1-carboxylate Openeye Name: ethyl (1R,2R,3E)-3-[ethoxy(hydroxy)methylene]-4-oxo-2-phenyl-cyclohexanecarboxylate CAS Name: (1R,2R,3E)-3-[ethoxy(hydroxy)methylidene]-4-oxo-2-phenyl-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl (1R,2R,3E)-3-[ethoxy(hydroxy)methylidene]-4-oxo-2-phenylcyclohexane-1-carboxylate Traditional Name: (1R,2R,3E)-3-[ethoxy(hydroxy)methylene]-4-keto-2-phenyl-cyclohexanecarboxylic acid ethyl ester Formula: C18H22O5 MolecularWeight: 318.36428

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(=O)C(=C(O)OCC)C1C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)[C@@H]1CCC(=O)/C(=C(\O)/OCC)/[C@H]1C2=CC=CC=C2

InChI

InChI=1S/C18H22O5/c1-3-22-17(20)13-10-11-14(19)16(18(21)23-4-2)15(13)12-8-6-5-7-9-12/h5-9,13,15,21H,3-4,10-11H2,1-2H3/b18-16-/t13-,15+/m1/s1