(4-methyl-4-oxidanyl-pentan-2-yl) benzoate

Systemtic Name: (4-methyl-4-oxidanyl-pentan-2-yl) benzoate Openeye Name: (3-hydroxy-1,3-dimethyl-butyl) benzoate CAS Name: benzoic acid (4-hydroxy-4-methylpentan-2-yl) ester IUPAC Name: (4-hydroxy-4-methylpentan-2-yl) benzoate Traditional Name: benzoic acid (3-hydroxy-1,3-dimethyl-butyl) ester Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O3/c1-10(9-13(2,3)15)16-12(14)11-7-5-4-6-8-11/h4-8,10,15H,9H2,1-3H3