methyl 4-(2,5-dimethoxyphenyl)-4-oxidanyl-but-2-ynoate

Systemtic Name: methyl 4-(2,5-dimethoxyphenyl)-4-oxidanyl-but-2-ynoate Openeye Name: methyl 4-(2,5-dimethoxyphenyl)-4-hydroxy-but-2-ynoate CAS Name: 4-(2,5-dimethoxyphenyl)-4-hydroxy-2-butynoic acid methyl ester IUPAC Name: methyl 4-(2,5-dimethoxyphenyl)-4-hydroxybut-2-ynoate Traditional Name: 4-(2,5-dimethoxyphenyl)-4-hydroxy-but-2-ynoic acid methyl ester Formula: C13H14O5 MolecularWeight: 250.24726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14O5/c1-16-9-4-6-12(17-2)10(8-9)11(14)5-7-13(15)18-3/h4,6,8,11,14H,1-3H3