3-[2-(1-oxidanylcyclohexyl)ethynyl]chromen-4-one

Systemtic Name: 3-[2-(1-oxidanylcyclohexyl)ethynyl]chromen-4-one Openeye Name: 3-[2-(1-hydroxycyclohexyl)ethynyl]chromen-4-one CAS Name: 3-[2-(1-hydroxycyclohexyl)ethynyl]-1-benzopyran-4-one IUPAC Name: 3-[2-(1-hydroxycyclohexyl)ethynyl]chromen-4-one Traditional Name: 3-[2-(1-hydroxycyclohexyl)ethynyl]chromone Formula: C17H16O3 MolecularWeight: 268.30714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C#CC2=COC3=CC=CC=C3C2=O)O

Isomeric SMILES

C1CCC(CC1)(C#CC2=COC3=CC=CC=C3C2=O)O

InChI

InChI=1S/C17H16O3/c18-16-13(8-11-17(19)9-4-1-5-10-17)12-20-15-7-3-2-6-14(15)16/h2-3,6-7,12,19H,1,4-5,9-10H2