4-(2-oxidanylcyclohexyl)-1-phenyl-but-2-yn-1-one

Systemtic Name: 4-(2-oxidanylcyclohexyl)-1-phenyl-but-2-yn-1-one Openeye Name: 4-(2-hydroxycyclohexyl)-1-phenyl-but-2-yn-1-one CAS Name: 4-(2-hydroxycyclohexyl)-1-phenyl-2-butyn-1-one IUPAC Name: 4-(2-hydroxycyclohexyl)-1-phenylbut-2-yn-1-one Traditional Name: 4-(2-hydroxycyclohexyl)-1-phenyl-but-2-yn-1-one Formula: C16H18O2 MolecularWeight: 242.31292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)CC#CC(=O)C2=CC=CC=C2)O

Isomeric SMILES

C1CCC(C(C1)CC#CC(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C16H18O2/c17-15-11-5-4-9-14(15)10-6-12-16(18)13-7-2-1-3-8-13/h1-3,7-8,14-15,17H,4-5,9-11H2