(3R)-3-(4-ethylphenyl)-4,4-dimethyl-pentanoic acid

Systemtic Name: (3R)-3-(4-ethylphenyl)-4,4-dimethyl-pentanoic acid Openeye Name: (3R)-3-(4-ethylphenyl)-4,4-dimethyl-pentanoic acid CAS Name: (3R)-3-(4-ethylphenyl)-4,4-dimethylpentanoic acid IUPAC Name: (3R)-3-(4-ethylphenyl)-4,4-dimethylpentanoic acid Traditional Name: (3R)-3-(4-ethylphenyl)-4,4-dimethyl-valeric acid Formula: C15H22O2 MolecularWeight: 234.33398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CC(=O)O)C(C)(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](CC(=O)O)C(C)(C)C

InChI

InChI=1S/C15H22O2/c1-5-11-6-8-12(9-7-11)13(10-14(16)17)15(2,3)4/h6-9,13H,5,10H2,1-4H3,(H,16,17)/t13-/m0/s1