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

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propan-1-one Openeye Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propan-1-one CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-1-propanone IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropan-1-one Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propan-1-one Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O3/c1-9(2)13(14)10-4-5-11-12(8-10)16-7-3-6-15-11/h4-5,8-9H,3,6-7H2,1-2H3