5-(2-methylbutan-2-yl)-1-benzofuran-3-one

Systemtic Name: 5-(2-methylbutan-2-yl)-1-benzofuran-3-one Openeye Name: 5-(1,1-dimethylpropyl)benzofuran-3-one CAS Name: 5-(2-methylbutan-2-yl)-3-benzofuranone IUPAC Name: 5-(2-methylbutan-2-yl)-1-benzofuran-3-one Traditional Name: 5-tert-amylcoumaran-3-one Formula: C13H16O2 MolecularWeight: 204.26494

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC2=C(C=C1)OCC2=O

Isomeric SMILES

CCC(C)(C)C1=CC2=C(C=C1)OCC2=O

InChI

InChI=1S/C13H16O2/c1-4-13(2,3)9-5-6-12-10(7-9)11(14)8-15-12/h5-7H,4,8H2,1-3H3