1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-methylpiperidin-1-ium-1-yl)propan-1-one

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-methylpiperidin-1-ium-1-yl)propan-1-one Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-methylpiperidin-1-ium-1-yl)propan-1-one CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-methyl-1-piperidin-1-iumyl)-1-propanone IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-methylpiperidin-1-ium-1-yl)propan-1-one Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-methylpiperidin-1-ium-1-yl)propan-1-one Formula: C17H24NO3+ MolecularWeight: 290.37736

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CCC(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C[N+]1(CCCCC1)CCC(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C17H24NO3/c1-18(8-3-2-4-9-18)10-7-15(19)14-5-6-16-17(13-14)21-12-11-20-16/h5-6,13H,2-4,7-12H2,1H3/q+1