4,4-dimethyl-2-(phenylmethyl)pentanoate

Systemtic Name: 4,4-dimethyl-2-(phenylmethyl)pentanoate Openeye Name: 2-benzyl-4,4-dimethyl-pentanoate CAS Name: 4,4-dimethyl-2-(phenylmethyl)pentanoate IUPAC Name: 2-benzyl-4,4-dimethylpentanoate Traditional Name: 2-benzyl-4,4-dimethyl-valerate Formula: C14H19O2- MolecularWeight: 219.29946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(CC1=CC=CC=C1)C(=O)[O-]

Isomeric SMILES

CC(C)(C)CC(CC1=CC=CC=C1)C(=O)[O-]

InChI

InChI=1S/C14H20O2/c1-14(2,3)10-12(13(15)16)9-11-7-5-4-6-8-11/h4-8,12H,9-10H2,1-3H3,(H,15,16)/p-1