3-[4-(2-methyl-2-oxidanyl-propanoyl)phenyl]propanoic acid

Systemtic Name: 3-[4-(2-methyl-2-oxidanyl-propanoyl)phenyl]propanoic acid Openeye Name: 3-[4-(2-hydroxy-2-methyl-propanoyl)phenyl]propanoic acid CAS Name: 3-[4-(2-hydroxy-2-methyl-1-oxopropyl)phenyl]propanoic acid IUPAC Name: 3-[4-(2-hydroxy-2-methylpropanoyl)phenyl]propanoic acid Traditional Name: 3-[4-(2-hydroxy-2-methyl-propanoyl)phenyl]propionic acid Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O4/c1-13(2,17)12(16)10-6-3-9(4-7-10)5-8-11(14)15/h3-4,6-7,17H,5,8H2,1-2H3,(H,14,15)