(4-hexyl-3-oxidanyl-phenyl) ethanoate

Systemtic Name: (4-hexyl-3-oxidanyl-phenyl) ethanoate Openeye Name: (4-hexyl-3-hydroxy-phenyl) acetate CAS Name: acetic acid (4-hexyl-3-hydroxyphenyl) ester IUPAC Name: (4-hexyl-3-hydroxyphenyl) acetate Traditional Name: acetic acid (4-hexyl-3-hydroxy-phenyl) ester Formula: C14H20O3 MolecularWeight: 236.3068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C(C=C1)OC(=O)C)O

Isomeric SMILES

CCCCCCC1=C(C=C(C=C1)OC(=O)C)O

InChI

InChI=1S/C14H20O3/c1-3-4-5-6-7-12-8-9-13(10-14(12)16)17-11(2)15/h8-10,16H,3-7H2,1-2H3