5-heptyl-2-oxidanyl-2-pentyl-furan-3-one

Systemtic Name: 5-heptyl-2-oxidanyl-2-pentyl-furan-3-one Openeye Name: 5-heptyl-2-hydroxy-2-pentyl-furan-3-one CAS Name: 5-heptyl-2-hydroxy-2-pentyl-3-furanone IUPAC Name: 5-heptyl-2-hydroxy-2-pentylfuran-3-one Traditional Name: 2-amyl-5-heptyl-2-hydroxy-furan-3-one Formula: C16H28O3 MolecularWeight: 268.39172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC(=O)C(O1)(CCCCC)O

Isomeric SMILES

CCCCCCCC1=CC(=O)C(O1)(CCCCC)O

InChI

InChI=1S/C16H28O3/c1-3-5-7-8-9-11-14-13-15(17)16(18,19-14)12-10-6-4-2/h13,18H,3-12H2,1-2H3