(2-methyl-2-oxidanyl-dodecanoyl) benzoate

Systemtic Name: (2-methyl-2-oxidanyl-dodecanoyl) benzoate Openeye Name: (2-hydroxy-2-methyl-dodecanoyl) benzoate CAS Name: benzoic acid (2-hydroxy-2-methyl-1-oxododecyl) ester IUPAC Name: (2-hydroxy-2-methyldodecanoyl) benzoate Traditional Name: benzoic acid (2-hydroxy-2-methyl-dodecanoyl) ester Formula: C20H30O4 MolecularWeight: 334.4498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30O4/c1-3-4-5-6-7-8-9-13-16-20(2,23)19(22)24-18(21)17-14-11-10-12-15-17/h10-12,14-15,23H,3-9,13,16H2,1-2H3