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

Systemtic Name: [(1R,2S,5S)-5-methyl-2-propan-2-yl-cyclohexyl] (3R)-3-phenylbutanoate Openeye Name: [(1R,2S,5S)-2-isopropyl-5-methyl-cyclohexyl] (3R)-3-phenylbutanoate CAS Name: (3R)-3-phenylbutanoic acid [(1R,2S,5S)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5S)-5-methyl-2-propan-2-ylcyclohexyl] (3R)-3-phenylbutanoate Traditional Name: (3R)-3-phenylbutyric acid [(1R,2S,5S)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C20H30O2 MolecularWeight: 302.451

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30O2/c1-14(2)18-11-10-15(3)12-19(18)22-20(21)13-16(4)17-8-6-5-7-9-17/h5-9,14-16,18-19H,10-13H2,1-4H3/t15-,16+,18-,19+/m0/s1