diethyl (1R,2S,3R)-4-oxidanylidene-2-phenyl-cyclohexane-1,3-dicarboxylate

Systemtic Name: diethyl (1R,2S,3R)-4-oxidanylidene-2-phenyl-cyclohexane-1,3-dicarboxylate Openeye Name: diethyl (1R,2S,3R)-4-oxo-2-phenyl-cyclohexane-1,3-dicarboxylate CAS Name: (1R,2S,3R)-4-oxo-2-phenylcyclohexane-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl (1R,2S,3R)-4-oxo-2-phenylcyclohexane-1,3-dicarboxylate Traditional Name: (1R,2S,3R)-4-keto-2-phenyl-cyclohexane-1,3-dicarboxylic acid diethyl ester Formula: C18H22O5 MolecularWeight: 318.36428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

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/h5-9,13,15-16H,3-4,10-11H2,1-2H3/t13-,15+,16+/m1/s1