N-(1,3-benzodioxol-5-yl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(3S)-3-methyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Formula: C15H21N2O3+ MolecularWeight: 277.33884

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H20N2O3/c1-11-3-2-6-17(8-11)9-15(18)16-12-4-5-13-14(7-12)20-10-19-13/h4-5,7,11H,2-3,6,8-10H2,1H3,(H,16,18)/p+1/t11-/m0/s1