[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2-methoxy-3-oxidanylidene-butanoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2-methoxy-3-oxidanylidene-butanoate Openeye Name: [(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] 2-methoxy-3-oxo-butanoate CAS Name: 2-methoxy-3-oxobutanoic acid [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2-methoxy-3-oxobutanoate Traditional Name: 3-keto-2-methoxy-butyric acid [(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl] ester Formula: C21H30O4 MolecularWeight: 346.4605

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C(C(=O)C)OC)C(C)(C)C2=CC=CC=C2

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C(C(=O)C)OC)C(C)(C)C2=CC=CC=C2

InChI

InChI=1S/C21H30O4/c1-14-11-12-17(21(3,4)16-9-7-6-8-10-16)18(13-14)25-20(23)19(24-5)15(2)22/h6-10,14,17-19H,11-13H2,1-5H3/t14-,17-,18-,19?/m1/s1