[(E)-1-oxidanylbut-1-enyl] 3-ethanoyl-2,4-dimethyl-benzoate

Systemtic Name: [(E)-1-oxidanylbut-1-enyl] 3-ethanoyl-2,4-dimethyl-benzoate Openeye Name: [(E)-1-hydroxybut-1-enyl] 3-acetyl-2,4-dimethyl-benzoate CAS Name: 3-acetyl-2,4-dimethylbenzoic acid [(E)-1-hydroxybut-1-enyl] ester IUPAC Name: [(E)-1-hydroxybut-1-enyl] 3-acetyl-2,4-dimethylbenzoate Traditional Name: 3-acetyl-2,4-dimethyl-benzoic acid [(E)-1-hydroxybut-1-enyl] ester Formula: C15H18O4 MolecularWeight: 262.30102

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Descriptors Computed from Structure

Canonical SMILES:

CCC=C(O)OC(=O)C1=C(C(=C(C=C1)C)C(=O)C)C

Isomeric SMILES

CC/C=C(\O)/OC(=O)C1=C(C(=C(C=C1)C)C(=O)C)C

InChI

InChI=1S/C15H18O4/c1-5-6-13(17)19-15(18)12-8-7-9(2)14(10(12)3)11(4)16/h6-8,17H,5H2,1-4H3/b13-6+