(2-methyl-2-oxidanyl-octanoyl) benzoate

Systemtic Name: (2-methyl-2-oxidanyl-octanoyl) benzoate Openeye Name: (2-hydroxy-2-methyl-octanoyl) benzoate CAS Name: benzoic acid (2-hydroxy-2-methyl-1-oxooctyl) ester IUPAC Name: (2-hydroxy-2-methyloctanoyl) benzoate Traditional Name: benzoic acid (2-hydroxy-2-methyl-octanoyl) ester Formula: C16H22O4 MolecularWeight: 278.34348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22O4/c1-3-4-5-9-12-16(2,19)15(18)20-14(17)13-10-7-6-8-11-13/h6-8,10-11,19H,3-5,9,12H2,1-2H3