2-[(1S,2R)-1-methoxy-2-phenyl-cyclohexyl]ethynylbenzene

Systemtic Name: 2-[(1S,2R)-1-methoxy-2-phenyl-cyclohexyl]ethynylbenzene Openeye Name: 2-[(1S,2R)-1-methoxy-2-phenyl-cyclohexyl]ethynylbenzene CAS Name: 2-[(1S,2R)-1-methoxy-2-phenylcyclohexyl]ethynylbenzene IUPAC Name: 2-[(1S,2R)-1-methoxy-2-phenylcyclohexyl]ethynylbenzene Traditional Name: 2-[(1S,2R)-1-methoxy-2-phenyl-cyclohexyl]ethynylbenzene Formula: C21H22O MolecularWeight: 290.39878

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CCCCC1C2=CC=CC=C2)C#CC3=CC=CC=C3

Isomeric SMILES

CO[C@]1(CCCC[C@@H]1C2=CC=CC=C2)C#CC3=CC=CC=C3

InChI

InChI=1S/C21H22O/c1-22-21(17-15-18-10-4-2-5-11-18)16-9-8-14-20(21)19-12-6-3-7-13-19/h2-7,10-13,20H,8-9,14,16H2,1H3/t20-,21-/m1/s1