5,7-bis(2-methylbutan-2-yl)-1-benzofuran-3-one

Systemtic Name: 5,7-bis(2-methylbutan-2-yl)-1-benzofuran-3-one Openeye Name: 5,7-bis(1,1-dimethylpropyl)benzofuran-3-one CAS Name: 5,7-bis(2-methylbutan-2-yl)-3-benzofuranone IUPAC Name: 5,7-bis(2-methylbutan-2-yl)-1-benzofuran-3-one Traditional Name: 5,7-ditert-amylcoumaran-3-one Formula: C18H26O2 MolecularWeight: 274.39784

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C2C(=C1)C(=O)CO2)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C2C(=C1)C(=O)CO2)C(C)(C)CC

InChI

InChI=1S/C18H26O2/c1-7-17(3,4)12-9-13-15(19)11-20-16(13)14(10-12)18(5,6)8-2/h9-10H,7-8,11H2,1-6H3