(1-ethynyl-4-phenyl-cyclohexyl) ethanoate

Systemtic Name: (1-ethynyl-4-phenyl-cyclohexyl) ethanoate Openeye Name: (1-ethynyl-4-phenyl-cyclohexyl) acetate CAS Name: acetic acid (1-ethynyl-4-phenylcyclohexyl) ester IUPAC Name: (1-ethynyl-4-phenylcyclohexyl) acetate Traditional Name: acetic acid (1-ethynyl-4-phenyl-cyclohexyl) ester Formula: C16H18O2 MolecularWeight: 242.31292

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(CCC(CC1)C2=CC=CC=C2)C#C

Isomeric SMILES

CC(=O)OC1(CCC(CC1)C2=CC=CC=C2)C#C

InChI

InChI=1S/C16H18O2/c1-3-16(18-13(2)17)11-9-15(10-12-16)14-7-5-4-6-8-14/h1,4-8,15H,9-12H2,2H3