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

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-methyl-butan-1-one Openeye Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-methyl-butan-1-one CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-methyl-1-butanone IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-methylbutan-1-one Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-methyl-butan-1-one Formula: C14H18O3 MolecularWeight: 234.29092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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