2-(3-phenylbutan-2-yl)propanedioic acid

Systemtic Name: 2-(3-phenylbutan-2-yl)propanedioic acid Openeye Name: 2-(1-methyl-2-phenyl-propyl)propanedioic acid CAS Name: 2-(3-phenylbutan-2-yl)propanedioic acid IUPAC Name: 2-(3-phenylbutan-2-yl)propanedioic acid Traditional Name: 2-(1-methyl-2-phenyl-propyl)malonic acid Formula: C13H16O4 MolecularWeight: 236.26374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O4/c1-8(10-6-4-3-5-7-10)9(2)11(12(14)15)13(16)17/h3-9,11H,1-2H3,(H,14,15)(H,16,17)