[4-[2-(4-methoxyphenyl)ethynyl]-2,6-dimethyl-phenyl] 2-methylbutanoate

Systemtic Name: [4-[2-(4-methoxyphenyl)ethynyl]-2,6-dimethyl-phenyl] 2-methylbutanoate Openeye Name: [4-[2-(4-methoxyphenyl)ethynyl]-2,6-dimethyl-phenyl] 2-methylbutanoate CAS Name: 2-methylbutanoic acid [4-[2-(4-methoxyphenyl)ethynyl]-2,6-dimethylphenyl] ester IUPAC Name: [4-[2-(4-methoxyphenyl)ethynyl]-2,6-dimethylphenyl] 2-methylbutanoate Traditional Name: 2-methylbutyric acid [4-[2-(4-methoxyphenyl)ethynyl]-2,6-dimethyl-phenyl] ester Formula: C22H24O3 MolecularWeight: 336.42416

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OC1=C(C=C(C=C1C)C#CC2=CC=C(C=C2)OC)C

Isomeric SMILES

CCC(C)C(=O)OC1=C(C=C(C=C1C)C#CC2=CC=C(C=C2)OC)C

InChI

InChI=1S/C22H24O3/c1-6-15(2)22(23)25-21-16(3)13-19(14-17(21)4)8-7-18-9-11-20(24-5)12-10-18/h9-15H,6H2,1-5H3