7-(2-methylbutyl)-1,5-benzodioxepin-3-one

Systemtic Name: 7-(2-methylbutyl)-1,5-benzodioxepin-3-one Openeye Name: 7-(2-methylbutyl)-1,5-benzodioxepin-3-one CAS Name: 7-(2-methylbutyl)-1,5-benzodioxepin-3-one IUPAC Name: 7-(2-methylbutyl)-1,5-benzodioxepin-3-one Traditional Name: 7-(2-methylbutyl)-1,5-benzodioxepin-3-one Formula: C14H18O3 MolecularWeight: 234.29092

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC1=CC2=C(C=C1)OCC(=O)CO2

Isomeric SMILES

CCC(C)CC1=CC2=C(C=C1)OCC(=O)CO2

InChI

InChI=1S/C14H18O3/c1-3-10(2)6-11-4-5-13-14(7-11)17-9-12(15)8-16-13/h4-5,7,10H,3,6,8-9H2,1-2H3