1-[(2R)-3-(1,3-benzodioxol-5-yl)-2-oxidanyl-propyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(2R)-3-(1,3-benzodioxol-5-yl)-2-oxidanyl-propyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(2R)-3-(1,3-benzodioxol-5-yl)-2-hydroxy-propyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(2R)-3-(1,3-benzodioxol-5-yl)-2-hydroxypropyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2R)-3-(1,3-benzodioxol-5-yl)-2-hydroxypropyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(2R)-3-(1,3-benzodioxol-5-yl)-2-hydroxy-propyl]piperidin-1-ium-4-carboxamide Formula: C16H23N2O4+ MolecularWeight: 307.36482

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N)CC(CC2=CC3=C(C=C2)OCO3)O

Isomeric SMILES

C1C[NH+](CCC1C(=O)N)C[C@@H](CC2=CC3=C(C=C2)OCO3)O

InChI

InChI=1S/C16H22N2O4/c17-16(20)12-3-5-18(6-4-12)9-13(19)7-11-1-2-14-15(8-11)22-10-21-14/h1-2,8,12-13,19H,3-7,9-10H2,(H2,17,20)/p+1/t13-/m1/s1