(3S,6S)-N-(1,3-benzodioxol-5-yl)-6-methyl-piperidin-1-ium-3-carboxamide

Systemtic Name: (3S,6S)-N-(1,3-benzodioxol-5-yl)-6-methyl-piperidin-1-ium-3-carboxamide Openeye Name: (3S,6S)-N-(1,3-benzodioxol-5-yl)-6-methyl-piperidin-1-ium-3-carboxamide CAS Name: (3S,6S)-N-(1,3-benzodioxol-5-yl)-6-methyl-3-piperidin-1-iumcarboxamide IUPAC Name: (3S,6S)-N-(1,3-benzodioxol-5-yl)-6-methylpiperidin-1-ium-3-carboxamide Traditional Name: (3S,6S)-N-(1,3-benzodioxol-5-yl)-6-methyl-piperidin-1-ium-3-carboxamide Formula: C14H19N2O3+ MolecularWeight: 263.31226

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C[NH2+]1)C(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[C@H]1CC[C@@H](C[NH2+]1)C(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H18N2O3/c1-9-2-3-10(7-15-9)14(17)16-11-4-5-12-13(6-11)19-8-18-12/h4-6,9-10,15H,2-3,7-8H2,1H3,(H,16,17)/p+1/t9-,10-/m0/s1