(E)-3,6-dimethyl-3-oxidanyl-7-phenoxy-hept-5-en-2-one

Systemtic Name: (E)-3,6-dimethyl-3-oxidanyl-7-phenoxy-hept-5-en-2-one Openeye Name: (E)-3-hydroxy-3,6-dimethyl-7-phenoxy-hept-5-en-2-one CAS Name: (E)-3-hydroxy-3,6-dimethyl-7-phenoxy-5-hepten-2-one IUPAC Name: (E)-3-hydroxy-3,6-dimethyl-7-phenoxyhept-5-en-2-one Traditional Name: (E)-3-hydroxy-3,6-dimethyl-7-phenoxy-hept-5-en-2-one Formula: C15H20O3 MolecularWeight: 248.3175

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC(C)(C(=O)C)O)COC1=CC=CC=C1

Isomeric SMILES

C/C(=C\CC(C)(C(=O)C)O)/COC1=CC=CC=C1

InChI

InChI=1S/C15H20O3/c1-12(9-10-15(3,17)13(2)16)11-18-14-7-5-4-6-8-14/h4-9,17H,10-11H2,1-3H3/b12-9+