methyl 2-ethynyl-4,5-dimethoxy-benzoate

Systemtic Name: methyl 2-ethynyl-4,5-dimethoxy-benzoate Openeye Name: methyl 2-ethynyl-4,5-dimethoxy-benzoate CAS Name: 2-ethynyl-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-ethynyl-4,5-dimethoxybenzoate Traditional Name: 2-ethynyl-4,5-dimethoxy-benzoic acid methyl ester Formula: C12H12O4 MolecularWeight: 220.22128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12O4/c1-5-8-6-10(14-2)11(15-3)7-9(8)12(13)16-4/h1,6-7H,2-4H3