4,4-dimethyl-6-methylidene-5-(phenylmethyl)cyclohex-2-en-1-one

Systemtic Name: 4,4-dimethyl-6-methylidene-5-(phenylmethyl)cyclohex-2-en-1-one Openeye Name: 5-benzyl-4,4-dimethyl-6-methylene-cyclohex-2-en-1-one CAS Name: 4,4-dimethyl-6-methylene-5-(phenylmethyl)-1-cyclohex-2-enone IUPAC Name: 5-benzyl-4,4-dimethyl-6-methylidenecyclohex-2-en-1-one Traditional Name: 5-benzyl-4,4-dimethyl-6-methylene-cyclohex-2-en-1-one Formula: C16H18O MolecularWeight: 226.31352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC(=O)C(=C)C1CC2=CC=CC=C2)C

Isomeric SMILES

CC1(C=CC(=O)C(=C)C1CC2=CC=CC=C2)C

InChI

InChI=1S/C16H18O/c1-12-14(11-13-7-5-4-6-8-13)16(2,3)10-9-15(12)17/h4-10,14H,1,11H2,2-3H3