(2E)-4,4-dimethyl-2-(phenylmethylidene)pentanoic acid

Systemtic Name: (2E)-4,4-dimethyl-2-(phenylmethylidene)pentanoic acid Openeye Name: (2E)-2-benzylidene-4,4-dimethyl-pentanoic acid CAS Name: (2E)-4,4-dimethyl-2-(phenylmethylene)pentanoic acid IUPAC Name: (2E)-2-benzylidene-4,4-dimethylpentanoic acid Traditional Name: (E)-2-neopentyl-3-phenyl-acrylic acid Formula: C14H18O2 MolecularWeight: 218.29152

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)C/C(=C\C1=CC=CC=C1)/C(=O)O

InChI

InChI=1S/C14H18O2/c1-14(2,3)10-12(13(15)16)9-11-7-5-4-6-8-11/h4-9H,10H2,1-3H3,(H,15,16)/b12-9+