methyl 4-(3-methoxyphenyl)-4-oxidanylidene-but-2-ynoate

Systemtic Name: methyl 4-(3-methoxyphenyl)-4-oxidanylidene-but-2-ynoate Openeye Name: methyl 4-(3-methoxyphenyl)-4-oxo-but-2-ynoate CAS Name: 4-(3-methoxyphenyl)-4-oxo-2-butynoic acid methyl ester IUPAC Name: methyl 4-(3-methoxyphenyl)-4-oxobut-2-ynoate Traditional Name: 4-keto-4-(3-methoxyphenyl)but-2-ynoic acid methyl ester Formula: C12H10O4 MolecularWeight: 218.2054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10O4/c1-15-10-5-3-4-9(8-10)11(13)6-7-12(14)16-2/h3-5,8H,1-2H3