2-ethynyl-1-(4-fluorophenyl)-3,3,5,5-tetramethyl-cyclohexene

Systemtic Name: 2-ethynyl-1-(4-fluorophenyl)-3,3,5,5-tetramethyl-cyclohexene Openeye Name: 2-ethynyl-1-(4-fluorophenyl)-3,3,5,5-tetramethyl-cyclohexene CAS Name: 2-ethynyl-1-(4-fluorophenyl)-3,3,5,5-tetramethylcyclohexene IUPAC Name: 2-ethynyl-1-(4-fluorophenyl)-3,3,5,5-tetramethylcyclohexene Traditional Name: 2-ethynyl-1-(4-fluorophenyl)-3,3,5,5-tetramethyl-cyclohexene Formula: C18H21F MolecularWeight: 256.357743

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(C1)(C)C)C#C)C2=CC=C(C=C2)F)C

Isomeric SMILES

CC1(CC(=C(C(C1)(C)C)C#C)C2=CC=C(C=C2)F)C

InChI

InChI=1S/C18H21F/c1-6-16-15(13-7-9-14(19)10-8-13)11-17(2,3)12-18(16,4)5/h1,7-10H,11-12H2,2-5H3