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Specification
The molecular formula is C16H16O3.
The molecular weight is 256.30 g/mol.
The IUPAC name is 3,5-dimethyl-4-phenylmethoxybenzoic acid.
The InChI is InChI=1S/C16H16O3/c1-11-8-14(16(17)18)9-12(2)15(11)19-10-13-6-4-3-5-7-13/h3-9H,10H2,1-2H3,(H,17,18).
The InChIKey is JABUPJCJZZNUFK-UHFFFAOYSA-N.
The canonical SMILES is CC1=CC(=CC(=C1OCC2=CC=CC=C2)C)C(=O)O.
The CAS number is 97888-80-7.
The European Community (EC) number is 925-930-2.
The DSSTox Substance ID is DTXSID00370073.
Yes, it is canonicalized.