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

Systemtic Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetamide CAS Name: N-[(1,3-benzodioxol-5-ylamino)-oxomethyl]-2-[(2S)-2-methyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetamide Traditional Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetamide Formula: C16H22N3O4+ MolecularWeight: 320.36358

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC(=O)NC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O4/c1-11-4-2-3-7-19(11)9-15(20)18-16(21)17-12-5-6-13-14(8-12)23-10-22-13/h5-6,8,11H,2-4,7,9-10H2,1H3,(H2,17,18,20,21)/p+1/t11-/m0/s1