(E)-6-cyclohexyl-2,2-dimethyl-6-phenylmethoxy-hex-4-en-3-one

Systemtic Name: (E)-6-cyclohexyl-2,2-dimethyl-6-phenylmethoxy-hex-4-en-3-one Openeye Name: (E)-6-benzyloxy-6-cyclohexyl-2,2-dimethyl-hex-4-en-3-one CAS Name: (E)-6-cyclohexyl-2,2-dimethyl-6-phenylmethoxy-4-hexen-3-one IUPAC Name: (E)-6-cyclohexyl-2,2-dimethyl-6-phenylmethoxyhex-4-en-3-one Traditional Name: (E)-6-benzoxy-6-cyclohexyl-2,2-dimethyl-hex-4-en-3-one Formula: C21H30O2 MolecularWeight: 314.4617

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C=CC(C1CCCCC1)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C(=O)/C=C/C(C1CCCCC1)OCC2=CC=CC=C2

InChI

InChI=1S/C21H30O2/c1-21(2,3)20(22)15-14-19(18-12-8-5-9-13-18)23-16-17-10-6-4-7-11-17/h4,6-7,10-11,14-15,18-19H,5,8-9,12-13,16H2,1-3H3/b15-14+