3-methyl-3-(phenylmethyl)pent-4-en-2-one

Systemtic Name: 3-methyl-3-(phenylmethyl)pent-4-en-2-one Openeye Name: 3-benzyl-3-methyl-pent-4-en-2-one CAS Name: 3-methyl-3-(phenylmethyl)-4-penten-2-one IUPAC Name: 3-benzyl-3-methylpent-4-en-2-one Traditional Name: 3-benzyl-3-methyl-pent-4-en-2-one Formula: C13H16O MolecularWeight: 188.26554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C)(CC1=CC=CC=C1)C=C

Isomeric SMILES

CC(=O)C(C)(CC1=CC=CC=C1)C=C

InChI

InChI=1S/C13H16O/c1-4-13(3,11(2)14)10-12-8-6-5-7-9-12/h4-9H,1,10H2,2-3H3