(3S,6S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methyl-piperidin-1-ium-3-carboxamide

Systemtic Name: (3S,6S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methyl-piperidin-1-ium-3-carboxamide Openeye Name: (3S,6S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methyl-piperidin-1-ium-3-carboxamide CAS Name: (3S,6S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methyl-3-piperidin-1-iumcarboxamide IUPAC Name: (3S,6S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methylpiperidin-1-ium-3-carboxamide Traditional Name: (3S,6S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methyl-piperidin-1-ium-3-carboxamide Formula: C15H21N2O3+ MolecularWeight: 277.33884

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C[NH2+]1)C(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C[C@H]1CC[C@@H](C[NH2+]1)C(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C15H20N2O3/c1-10-2-3-11(9-16-10)15(18)17-12-4-5-13-14(8-12)20-7-6-19-13/h4-5,8,10-11,16H,2-3,6-7,9H2,1H3,(H,17,18)/p+1/t10-,11-/m0/s1