[(E)-2,3-dimethyl-4-oxidanyl-hex-2-enyl] benzoate

Systemtic Name: [(E)-2,3-dimethyl-4-oxidanyl-hex-2-enyl] benzoate Openeye Name: [(E)-4-hydroxy-2,3-dimethyl-hex-2-enyl] benzoate CAS Name: benzoic acid [(E)-4-hydroxy-2,3-dimethylhex-2-enyl] ester IUPAC Name: [(E)-4-hydroxy-2,3-dimethylhex-2-enyl] benzoate Traditional Name: benzoic acid [(E)-4-hydroxy-2,3-dimethyl-hex-2-enyl] ester Formula: C15H20O3 MolecularWeight: 248.3175

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=C(C)COC(=O)C1=CC=CC=C1)C)O

Isomeric SMILES

CCC(/C(=C(\C)/COC(=O)C1=CC=CC=C1)/C)O

InChI

InChI=1S/C15H20O3/c1-4-14(16)12(3)11(2)10-18-15(17)13-8-6-5-7-9-13/h5-9,14,16H,4,10H2,1-3H3/b12-11+