2-(1,3-benzodioxol-5-ylmethyl)cyclohexan-1-one

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyl)cyclohexan-1-one Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)cyclohexanone CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-1-cyclohexanone IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyl)cyclohexan-1-one Traditional Name: 2-piperonylcyclohexanone Formula: C14H16O3 MolecularWeight: 232.27504

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CCC(=O)C(C1)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H16O3/c15-12-4-2-1-3-11(12)7-10-5-6-13-14(8-10)17-9-16-13/h5-6,8,11H,1-4,7,9H2