N-(6-chloranyl-1,3-benzodioxol-5-yl)-2-(4-oxidanylpiperidin-1-ium-1-yl)ethanamide

Systemtic Name: N-(6-chloranyl-1,3-benzodioxol-5-yl)-2-(4-oxidanylpiperidin-1-ium-1-yl)ethanamide Openeye Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-(4-hydroxypiperidin-1-ium-1-yl)acetamide CAS Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-(4-hydroxy-1-piperidin-1-iumyl)acetamide IUPAC Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-(4-hydroxypiperidin-1-ium-1-yl)acetamide Traditional Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-(4-hydroxypiperidin-1-ium-1-yl)acetamide Formula: C14H18ClN2O4+ MolecularWeight: 313.75672

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1O)CC(=O)NC2=CC3=C(C=C2Cl)OCO3

Isomeric SMILES

C1C[NH+](CCC1O)CC(=O)NC2=CC3=C(C=C2Cl)OCO3

InChI

InChI=1S/C14H17ClN2O4/c15-10-5-12-13(21-8-20-12)6-11(10)16-14(19)7-17-3-1-9(18)2-4-17/h5-6,9,18H,1-4,7-8H2,(H,16,19)/p+1