[(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl] (1S,2R)-2-methyl-2-phenyl-cyclopropane-1-carboxylate

Systemtic Name: [(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl] (1S,2R)-2-methyl-2-phenyl-cyclopropane-1-carboxylate Openeye Name: [(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexyl] (1S,2R)-2-methyl-2-phenyl-cyclopropanecarboxylate CAS Name: (1S,2R)-2-methyl-2-phenyl-1-cyclopropanecarboxylic acid [(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl] (1S,2R)-2-methyl-2-phenylcyclopropane-1-carboxylate Traditional Name: (1S,2R)-2-methyl-2-phenyl-cyclopropanecarboxylic acid [(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C21H30O2 MolecularWeight: 314.4617

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2CC2(C)C3=CC=CC=C3)C(C)C

Isomeric SMILES

C[C@H]1CC[C@@H]([C@H](C1)OC(=O)[C@H]2C[C@@]2(C)C3=CC=CC=C3)C(C)C

InChI

InChI=1S/C21H30O2/c1-14(2)17-11-10-15(3)12-19(17)23-20(22)18-13-21(18,4)16-8-6-5-7-9-16/h5-9,14-15,17-19H,10-13H2,1-4H3/t15-,17+,18+,19-,21-/m0/s1