1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)octan-1-one

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)octan-1-one Openeye Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)octan-1-one CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-octanone IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)octan-1-one Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)octan-1-one Formula: C17H24O3 MolecularWeight: 276.37066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=CC2=C(C=C1)OCCCO2

Isomeric SMILES

CCCCCCCC(=O)C1=CC2=C(C=C1)OCCCO2

InChI

InChI=1S/C17H24O3/c1-2-3-4-5-6-8-15(18)14-9-10-16-17(13-14)20-12-7-11-19-16/h9-10,13H,2-8,11-12H2,1H3