[(1S,3R)-3-ethynyl-4-methylidene-cyclohexyl]oxymethylbenzene

Systemtic Name: [(1S,3R)-3-ethynyl-4-methylidene-cyclohexyl]oxymethylbenzene Openeye Name: [(1S,3R)-3-ethynyl-4-methylene-cyclohexoxy]methylbenzene CAS Name: [(1S,3R)-3-ethynyl-4-methylenecyclohexyl]oxymethylbenzene IUPAC Name: [(1S,3R)-3-ethynyl-4-methylidenecyclohexyl]oxymethylbenzene Traditional Name: [(1S,3R)-3-ethynyl-4-methylene-cyclohexoxy]methylbenzene Formula: C16H18O MolecularWeight: 226.31352

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Descriptors Computed from Structure

Canonical SMILES:

C=C1CCC(CC1C#C)OCC2=CC=CC=C2

Isomeric SMILES

C=C1CC[C@@H](C[C@H]1C#C)OCC2=CC=CC=C2

InChI

InChI=1S/C16H18O/c1-3-15-11-16(10-9-13(15)2)17-12-14-7-5-4-6-8-14/h1,4-8,15-16H,2,9-12H2/t15-,16+/m1/s1