N-[(2R)-2-(1,3-benzodioxol-5-yl)-2-morpholin-4-ium-4-yl-ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(2R)-2-(1,3-benzodioxol-5-yl)-2-morpholin-4-ium-4-yl-ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(2R)-2-(1,3-benzodioxol-5-yl)-2-morpholin-4-ium-4-yl-ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[(2R)-2-(1,3-benzodioxol-5-yl)-2-(4-morpholin-4-iumyl)ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(2R)-2-(1,3-benzodioxol-5-yl)-2-morpholin-4-ium-4-ylethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(2R)-2-(1,3-benzodioxol-5-yl)-2-morpholin-4-ium-4-yl-ethyl]-piperonylamide Formula: C21H23N2O6+ MolecularWeight: 399.41712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(CNC(=O)C2=CC3=C(C=C2)OCO3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1COCC[NH+]1[C@@H](CNC(=O)C2=CC3=C(C=C2)OCO3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H22N2O6/c24-21(15-2-4-18-20(10-15)29-13-27-18)22-11-16(23-5-7-25-8-6-23)14-1-3-17-19(9-14)28-12-26-17/h1-4,9-10,16H,5-8,11-13H2,(H,22,24)/p+1/t16-/m0/s1