2-[4-(1,3-benzodioxol-5-yl)-4-oxidanyl-piperidin-1-ium-1-yl]-N,N-diethyl-ethanamide

Systemtic Name: 2-[4-(1,3-benzodioxol-5-yl)-4-oxidanyl-piperidin-1-ium-1-yl]-N,N-diethyl-ethanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-yl)-4-hydroxy-piperidin-1-ium-1-yl]-N,N-diethyl-acetamide CAS Name: 2-[4-(1,3-benzodioxol-5-yl)-4-hydroxy-1-piperidin-1-iumyl]-N,N-diethylacetamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-yl)-4-hydroxypiperidin-1-ium-1-yl]-N,N-diethylacetamide Traditional Name: 2-[4-(1,3-benzodioxol-5-yl)-4-hydroxy-piperidin-1-ium-1-yl]-N,N-diethyl-acetamide Formula: C18H27N2O4+ MolecularWeight: 335.41798

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C[NH+]1CCC(CC1)(C2=CC3=C(C=C2)OCO3)O

Isomeric SMILES

CCN(CC)C(=O)C[NH+]1CCC(CC1)(C2=CC3=C(C=C2)OCO3)O

InChI

InChI=1S/C18H26N2O4/c1-3-20(4-2)17(21)12-19-9-7-18(22,8-10-19)14-5-6-15-16(11-14)24-13-23-15/h5-6,11,22H,3-4,7-10,12-13H2,1-2H3/p+1