5-(phenylmethoxymethyl)cyclohexane-1,3-dione

Systemtic Name: 5-(phenylmethoxymethyl)cyclohexane-1,3-dione Openeye Name: 5-(benzyloxymethyl)cyclohexane-1,3-dione CAS Name: 5-(phenylmethoxymethyl)cyclohexane-1,3-dione IUPAC Name: 5-(phenylmethoxymethyl)cyclohexane-1,3-dione Traditional Name: 5-(benzoxymethyl)cyclohexane-1,3-quinone Formula: C14H16O3 MolecularWeight: 232.27504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)CC1=O)COCC2=CC=CC=C2

Isomeric SMILES

C1C(CC(=O)CC1=O)COCC2=CC=CC=C2

InChI

InChI=1S/C14H16O3/c15-13-6-12(7-14(16)8-13)10-17-9-11-4-2-1-3-5-11/h1-5,12H,6-10H2