1-(3,4,5-trimethoxyphenyl)hepta-2,6-diyn-1-one

Systemtic Name: 1-(3,4,5-trimethoxyphenyl)hepta-2,6-diyn-1-one Openeye Name: 1-(3,4,5-trimethoxyphenyl)hepta-2,6-diyn-1-one CAS Name: 1-(3,4,5-trimethoxyphenyl)-1-hepta-2,6-diynone IUPAC Name: 1-(3,4,5-trimethoxyphenyl)hepta-2,6-diyn-1-one Traditional Name: 1-(3,4,5-trimethoxyphenyl)hepta-2,6-diyn-1-one Formula: C16H16O4 MolecularWeight: 272.29584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16O4/c1-5-6-7-8-9-13(17)12-10-14(18-2)16(20-4)15(11-12)19-3/h1,10-11H,6-7H2,2-4H3