N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]acetamide CAS Name: N-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-oxomethyl]-2-[(3S,5S)-3,5-dimethyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]acetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]acetamide Formula: C18H26N3O4+ MolecularWeight: 348.41674

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CC(=O)NC(=O)NC2=CC3=C(C=C2)OCCO3)C

Isomeric SMILES

C[C@H]1C[C@@H](C[NH+](C1)CC(=O)NC(=O)NC2=CC3=C(C=C2)OCCO3)C

InChI

InChI=1S/C18H25N3O4/c1-12-7-13(2)10-21(9-12)11-17(22)20-18(23)19-14-3-4-15-16(8-14)25-6-5-24-15/h3-4,8,12-13H,5-7,9-11H2,1-2H3,(H2,19,20,22,23)/p+1/t12-,13-/m0/s1