(phenylmethyl) 3-tert-butyl-5-(2-methylbutan-2-yl)-4-oxidanyl-benzoate

Systemtic Name: (phenylmethyl) 3-tert-butyl-5-(2-methylbutan-2-yl)-4-oxidanyl-benzoate Openeye Name: benzyl 3-tert-butyl-5-(1,1-dimethylpropyl)-4-hydroxy-benzoate CAS Name: 3-tert-butyl-4-hydroxy-5-(2-methylbutan-2-yl)benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-tert-butyl-4-hydroxy-5-(2-methylbutan-2-yl)benzoate Traditional Name: 3-tert-amyl-5-tert-butyl-4-hydroxy-benzoic acid benzyl ester Formula: C23H30O3 MolecularWeight: 354.4825

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H30O3/c1-7-23(5,6)19-14-17(13-18(20(19)24)22(2,3)4)21(25)26-15-16-11-9-8-10-12-16/h8-14,24H,7,15H2,1-6H3