[2,2,4-trimethyl-1,3-bis(oxidanyl)pentyl] benzoate

Systemtic Name: [2,2,4-trimethyl-1,3-bis(oxidanyl)pentyl] benzoate Openeye Name: (1,3-dihydroxy-2,2,4-trimethyl-pentyl) benzoate CAS Name: benzoic acid (1,3-dihydroxy-2,2,4-trimethylpentyl) ester IUPAC Name: (1,3-dihydroxy-2,2,4-trimethylpentyl) benzoate Traditional Name: benzoic acid (1,3-dihydroxy-2,2,4-trimethyl-pentyl) ester Formula: C15H22O4 MolecularWeight: 266.33278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22O4/c1-10(2)12(16)15(3,4)14(18)19-13(17)11-8-6-5-7-9-11/h5-10,12,14,16,18H,1-4H3