2-octan-3-yl-4-oxidanyl-benzoate

Systemtic Name: 2-octan-3-yl-4-oxidanyl-benzoate Openeye Name: 2-(1-ethylhexyl)-4-hydroxy-benzoate CAS Name: 4-hydroxy-2-octan-3-ylbenzoate IUPAC Name: 4-hydroxy-2-octan-3-ylbenzoate Traditional Name: 2-(1-ethylhexyl)-4-hydroxy-benzoate Formula: C15H21O3- MolecularWeight: 249.32544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)C1=C(C=CC(=C1)O)C(=O)[O-]

Isomeric SMILES

CCCCCC(CC)C1=C(C=CC(=C1)O)C(=O)[O-]

InChI

InChI=1S/C15H22O3/c1-3-5-6-7-11(4-2)14-10-12(16)8-9-13(14)15(17)18/h8-11,16H,3-7H2,1-2H3,(H,17,18)/p-1