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

Systemtic Name: [(1R,2S,5S)-5-methyl-2-propan-2-yl-cyclohexyl] (2S)-2-methyl-3-oxidanylidene-2-(phenylmethyl)butanoate Openeye Name: [(1R,2S,5S)-2-isopropyl-5-methyl-cyclohexyl] (2S)-2-benzyl-2-methyl-3-oxo-butanoate CAS Name: (2S)-2-methyl-3-oxo-2-(phenylmethyl)butanoic acid [(1R,2S,5S)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5S)-5-methyl-2-propan-2-ylcyclohexyl] (2S)-2-benzyl-2-methyl-3-oxobutanoate Traditional Name: (2S)-2-benzyl-3-keto-2-methyl-butyric acid [(1R,2S,5S)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C22H32O3 MolecularWeight: 344.48768

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C(C)(CC2=CC=CC=C2)C(=O)C)C(C)C

Isomeric SMILES

C[C@H]1CC[C@H]([C@@H](C1)OC(=O)[C@@](C)(CC2=CC=CC=C2)C(=O)C)C(C)C

InChI

InChI=1S/C22H32O3/c1-15(2)19-12-11-16(3)13-20(19)25-21(24)22(5,17(4)23)14-18-9-7-6-8-10-18/h6-10,15-16,19-20H,11-14H2,1-5H3/t16-,19-,20+,22-/m0/s1