3-heptan-2-yloxy-3H-2-benzofuran-1-one

Systemtic Name: 3-heptan-2-yloxy-3H-2-benzofuran-1-one Openeye Name: 3-(1-methylhexoxy)-3H-isobenzofuran-1-one CAS Name: 3-heptan-2-yloxy-3H-isobenzofuran-1-one IUPAC Name: 3-heptan-2-yloxy-3H-2-benzofuran-1-one Traditional Name: 3-(1-methylhexoxy)phthalide Formula: C15H20O3 MolecularWeight: 248.3175

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)OC1C2=CC=CC=C2C(=O)O1

Isomeric SMILES

CCCCCC(C)OC1C2=CC=CC=C2C(=O)O1

InChI

InChI=1S/C15H20O3/c1-3-4-5-8-11(2)17-15-13-10-7-6-9-12(13)14(16)18-15/h6-7,9-11,15H,3-5,8H2,1-2H3