2-heptyl-3-(3-oxidanylprop-1-ynyl)-2H-furan-5-one

Systemtic Name: 2-heptyl-3-(3-oxidanylprop-1-ynyl)-2H-furan-5-one Openeye Name: 2-heptyl-3-(3-hydroxyprop-1-ynyl)-2H-furan-5-one CAS Name: 2-heptyl-3-(3-hydroxyprop-1-ynyl)-2H-furan-5-one IUPAC Name: 2-heptyl-3-(3-hydroxyprop-1-ynyl)-2H-furan-5-one Traditional Name: 2-heptyl-3-(3-hydroxyprop-1-ynyl)-2H-furan-5-one Formula: C14H20O3 MolecularWeight: 236.3068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C(=CC(=O)O1)C#CCO

Isomeric SMILES

CCCCCCCC1C(=CC(=O)O1)C#CCO

InChI

InChI=1S/C14H20O3/c1-2-3-4-5-6-9-13-12(8-7-10-15)11-14(16)17-13/h11,13,15H,2-6,9-10H2,1H3