3-butyl-4-oxidanyl-4,5-dihydro-3H-2-benzofuran-1-one

Systemtic Name: 3-butyl-4-oxidanyl-4,5-dihydro-3H-2-benzofuran-1-one Openeye Name: 3-butyl-4-hydroxy-4,5-dihydro-3H-isobenzofuran-1-one CAS Name: 3-butyl-4-hydroxy-4,5-dihydro-3H-isobenzofuran-1-one IUPAC Name: 3-butyl-4-hydroxy-4,5-dihydro-3H-2-benzofuran-1-one Traditional Name: 3-butyl-4-hydroxy-4,5-dihydro-3H-isobenzofuran-1-one Formula: C12H16O3 MolecularWeight: 208.25364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C2=C(C=CCC2O)C(=O)O1

Isomeric SMILES

CCCCC1C2=C(C=CCC2O)C(=O)O1

InChI

InChI=1S/C12H16O3/c1-2-3-7-10-11-8(12(14)15-10)5-4-6-9(11)13/h4-5,9-10,13H,2-3,6-7H2,1H3