methyl 2-[2-(2-hex-5-enoylphenyl)ethynyl]benzoate

Systemtic Name: methyl 2-[2-(2-hex-5-enoylphenyl)ethynyl]benzoate Openeye Name: methyl 2-[2-(2-hex-5-enoylphenyl)ethynyl]benzoate CAS Name: 2-[2-[2-(1-oxohex-5-enyl)phenyl]ethynyl]benzoic acid methyl ester IUPAC Name: methyl 2-[2-(2-hex-5-enoylphenyl)ethynyl]benzoate Traditional Name: 2-[2-(2-hex-5-enoylphenyl)ethynyl]benzoic acid methyl ester Formula: C22H20O3 MolecularWeight: 332.3924

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C#CC2=CC=CC=C2C(=O)CCCC=C

Isomeric SMILES

COC(=O)C1=CC=CC=C1C#CC2=CC=CC=C2C(=O)CCCC=C

InChI

InChI=1S/C22H20O3/c1-3-4-5-14-21(23)19-12-8-6-10-17(19)15-16-18-11-7-9-13-20(18)22(24)25-2/h3,6-13H,1,4-5,14H2,2H3