(phenylmethyl) 3,5-dimethyl-2-oxidanyl-benzoate

Systemtic Name: (phenylmethyl) 3,5-dimethyl-2-oxidanyl-benzoate Openeye Name: benzyl 2-hydroxy-3,5-dimethyl-benzoate CAS Name: 2-hydroxy-3,5-dimethylbenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-hydroxy-3,5-dimethylbenzoate Traditional Name: 2-hydroxy-3,5-dimethyl-benzoic acid benzyl ester Formula: C16H16O3 MolecularWeight: 256.29644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(=O)OCC2=CC=CC=C2)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C(=O)OCC2=CC=CC=C2)O)C

InChI

InChI=1S/C16H16O3/c1-11-8-12(2)15(17)14(9-11)16(18)19-10-13-6-4-3-5-7-13/h3-9,17H,10H2,1-2H3