4-oxidanylidene-4-(3,4,5-trimethoxyphenyl)but-2-ynal

Systemtic Name: 4-oxidanylidene-4-(3,4,5-trimethoxyphenyl)but-2-ynal Openeye Name: 4-oxo-4-(3,4,5-trimethoxyphenyl)but-2-ynal CAS Name: 4-oxo-4-(3,4,5-trimethoxyphenyl)-2-butynal IUPAC Name: 4-oxo-4-(3,4,5-trimethoxyphenyl)but-2-ynal Traditional Name: 4-keto-4-(3,4,5-trimethoxyphenyl)but-2-ynal Formula: C13H12O5 MolecularWeight: 248.23138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)C#CC=O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)C#CC=O

InChI

InChI=1S/C13H12O5/c1-16-11-7-9(10(15)5-4-6-14)8-12(17-2)13(11)18-3/h6-8H,1-3H3