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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=CC2=C(C=C1)OCC(=O)CO2

Isomeric SMILES

CC(C)CCC1=CC2=C(C=C1)OCC(=O)CO2

InChI

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