2-but-2-ynyl-2,6-dimethyl-cyclohexan-1-one

Systemtic Name: 2-but-2-ynyl-2,6-dimethyl-cyclohexan-1-one Openeye Name: 2-but-2-ynyl-2,6-dimethyl-cyclohexanone CAS Name: 2-but-2-ynyl-2,6-dimethyl-1-cyclohexanone IUPAC Name: 2-but-2-ynyl-2,6-dimethylcyclohexan-1-one Traditional Name: 2-but-2-ynyl-2,6-dimethyl-cyclohexanone Formula: C12H18O MolecularWeight: 178.27072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC#CCC1(CCCC(C1=O)C)C

Isomeric SMILES

CC#CCC1(CCCC(C1=O)C)C

InChI

InChI=1S/C12H18O/c1-4-5-8-12(3)9-6-7-10(2)11(12)13/h10H,6-9H2,1-3H3