3-[2-(2-methylpropyl)phenyl]-2-oxidanylidene-propanoic acid

Systemtic Name: 3-[2-(2-methylpropyl)phenyl]-2-oxidanylidene-propanoic acid Openeye Name: 3-(2-isobutylphenyl)-2-oxo-propanoic acid CAS Name: 3-[2-(2-methylpropyl)phenyl]-2-oxopropanoic acid IUPAC Name: 3-[2-(2-methylpropyl)phenyl]-2-oxopropanoic acid Traditional Name: 3-(2-isobutylphenyl)-2-keto-propionic acid Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=CC=C1CC(=O)C(=O)O

Isomeric SMILES

CC(C)CC1=CC=CC=C1CC(=O)C(=O)O

InChI

InChI=1S/C13H16O3/c1-9(2)7-10-5-3-4-6-11(10)8-12(14)13(15)16/h3-6,9H,7-8H2,1-2H3,(H,15,16)