methyl 3-tert-butyl-5-(hydroxymethyl)benzoate

Systemtic Name: methyl 3-tert-butyl-5-(hydroxymethyl)benzoate Openeye Name: methyl 3-tert-butyl-5-(hydroxymethyl)benzoate CAS Name: 3-tert-butyl-5-(hydroxymethyl)benzoic acid methyl ester IUPAC Name: methyl 3-tert-butyl-5-(hydroxymethyl)benzoate Traditional Name: 3-tert-butyl-5-methylol-benzoic acid methyl ester Formula: C13H18O3 MolecularWeight: 222.28022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)CO)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)CO)C(=O)OC

InChI

InChI=1S/C13H18O3/c1-13(2,3)11-6-9(8-14)5-10(7-11)12(15)16-4/h5-7,14H,8H2,1-4H3