2-heptyl-3-(2-phenylethynyl)-2H-furan-5-one

Systemtic Name: 2-heptyl-3-(2-phenylethynyl)-2H-furan-5-one Openeye Name: 2-heptyl-3-(2-phenylethynyl)-2H-furan-5-one CAS Name: 2-heptyl-3-(2-phenylethynyl)-2H-furan-5-one IUPAC Name: 2-heptyl-3-(2-phenylethynyl)-2H-furan-5-one Traditional Name: 2-heptyl-3-(2-phenylethynyl)-2H-furan-5-one Formula: C19H22O2 MolecularWeight: 282.37678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C(=CC(=O)O1)C#CC2=CC=CC=C2

Isomeric SMILES

CCCCCCCC1C(=CC(=O)O1)C#CC2=CC=CC=C2

InChI

InChI=1S/C19H22O2/c1-2-3-4-5-9-12-18-17(15-19(20)21-18)14-13-16-10-7-6-8-11-16/h6-8,10-11,15,18H,2-5,9,12H2,1H3