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

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethanone Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethanone CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methyl-1-piperidin-1-iumyl)ethanone IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethanone Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethanone Formula: C16H22NO3+ MolecularWeight: 276.35078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC1CC[NH+](CC1)CC(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C16H21NO3/c1-12-4-6-17(7-5-12)11-14(18)13-2-3-15-16(10-13)20-9-8-19-15/h2-3,10,12H,4-9,11H2,1H3/p+1