2-(5-methyl-5-oxidanyl-hexyl)benzoic acid

Systemtic Name: 2-(5-methyl-5-oxidanyl-hexyl)benzoic acid Openeye Name: 2-(5-hydroxy-5-methyl-hexyl)benzoic acid CAS Name: 2-(5-hydroxy-5-methylhexyl)benzoic acid IUPAC Name: 2-(5-hydroxy-5-methylhexyl)benzoic acid Traditional Name: 2-(5-hydroxy-5-methyl-hexyl)benzoic acid Formula: C14H20O3 MolecularWeight: 236.3068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCC1=CC=CC=C1C(=O)O)O

Isomeric SMILES

CC(C)(CCCCC1=CC=CC=C1C(=O)O)O

InChI

InChI=1S/C14H20O3/c1-14(2,17)10-6-5-8-11-7-3-4-9-12(11)13(15)16/h3-4,7,9,17H,5-6,8,10H2,1-2H3,(H,15,16)