diethyl (1S,2R,3R,4S)-4-methyl-4-oxidanyl-6-oxidanylidene-2-[(E)-2-phenylethenyl]cyclohexane-1,3-dicarboxylate

Systemtic Name: diethyl (1S,2R,3R,4S)-4-methyl-4-oxidanyl-6-oxidanylidene-2-[(E)-2-phenylethenyl]cyclohexane-1,3-dicarboxylate Openeye Name: diethyl (1S,2R,3R,4S)-4-hydroxy-4-methyl-6-oxo-2-[(E)-styryl]cyclohexane-1,3-dicarboxylate CAS Name: (1S,2R,3R,4S)-4-hydroxy-4-methyl-6-oxo-2-[(E)-2-phenylethenyl]cyclohexane-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl (1S,2R,3R,4S)-4-hydroxy-4-methyl-6-oxo-2-[(E)-2-phenylethenyl]cyclohexane-1,3-dicarboxylate Traditional Name: (1S,2R,3R,4S)-4-hydroxy-6-keto-4-methyl-2-[(E)-styryl]cyclohexane-1,3-dicarboxylic acid diethyl ester Formula: C21H26O6 MolecularWeight: 374.42754

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(C(CC1=O)(C)O)C(=O)OCC)C=CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)[C@H]1[C@@H]([C@H]([C@@](CC1=O)(C)O)C(=O)OCC)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C21H26O6/c1-4-26-19(23)17-15(12-11-14-9-7-6-8-10-14)18(20(24)27-5-2)21(3,25)13-16(17)22/h6-12,15,17-18,25H,4-5,13H2,1-3H3/b12-11+/t15-,17-,18-,21-/m0/s1