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

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-pentan-1-one Openeye Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-pentan-1-one CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-1-pentanone IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpentan-1-one Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-pentan-1-one Formula: C15H20O3 MolecularWeight: 248.3175

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20O3/c1-3-5-11(2)15(16)12-6-7-13-14(10-12)18-9-4-8-17-13/h6-7,10-11H,3-5,8-9H2,1-2H3