methyl 2-(2-ethynyl-4,5-dimethoxy-phenyl)ethanoate

Systemtic Name: methyl 2-(2-ethynyl-4,5-dimethoxy-phenyl)ethanoate Openeye Name: methyl 2-(2-ethynyl-4,5-dimethoxy-phenyl)acetate CAS Name: 2-(2-ethynyl-4,5-dimethoxyphenyl)acetic acid methyl ester IUPAC Name: methyl 2-(2-ethynyl-4,5-dimethoxyphenyl)acetate Traditional Name: 2-(2-ethynyl-4,5-dimethoxy-phenyl)acetic acid methyl ester Formula: C13H14O4 MolecularWeight: 234.24786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CC(=O)OC)C#C)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CC(=O)OC)C#C)OC

InChI

InChI=1S/C13H14O4/c1-5-9-6-11(15-2)12(16-3)7-10(9)8-13(14)17-4/h1,6-7H,8H2,2-4H3