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

Systemtic Name: 7-(2-methylbutan-2-yl)-1,5-benzodioxepin-3-one Openeye Name: 7-(1,1-dimethylpropyl)-1,5-benzodioxepin-3-one CAS Name: 7-(2-methylbutan-2-yl)-1,5-benzodioxepin-3-one IUPAC Name: 7-(2-methylbutan-2-yl)-1,5-benzodioxepin-3-one Traditional Name: 7-tert-amyl-1,5-benzodioxepin-3-one Formula: C14H18O3 MolecularWeight: 234.29092

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC2=C(C=C1)OCC(=O)CO2

Isomeric SMILES

CCC(C)(C)C1=CC2=C(C=C1)OCC(=O)CO2

InChI

InChI=1S/C14H18O3/c1-4-14(2,3)10-5-6-12-13(7-10)17-9-11(15)8-16-12/h5-7H,4,8-9H2,1-3H3