[(1R,2S)-2-phenylcyclohexyl] 2-bromanylbutanoate

Systemtic Name: [(1R,2S)-2-phenylcyclohexyl] 2-bromanylbutanoate Openeye Name: [(1R,2S)-2-phenylcyclohexyl] 2-bromobutanoate CAS Name: 2-bromobutanoic acid [(1R,2S)-2-phenylcyclohexyl] ester IUPAC Name: [(1R,2S)-2-phenylcyclohexyl] 2-bromobutanoate Traditional Name: 2-bromobutyric acid [(1R,2S)-2-phenylcyclohexyl] ester Formula: C16H21BrO2 MolecularWeight: 325.24074

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC1CCCCC1C2=CC=CC=C2)Br

Isomeric SMILES

CCC(C(=O)O[C@@H]1CCCC[C@H]1C2=CC=CC=C2)Br

InChI

InChI=1S/C16H21BrO2/c1-2-14(17)16(18)19-15-11-7-6-10-13(15)12-8-4-3-5-9-12/h3-5,8-9,13-15H,2,6-7,10-11H2,1H3/t13-,14?,15+/m0/s1