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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[(2R)-3-ethyl-2-(4-morpholin-4-iumyl)pentyl]propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[(2R)-3-ethyl-2-morpholin-4-ium-4-ylpentyl]propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]propionamide Formula: C21H33N2O4+ MolecularWeight: 377.49772

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(CNC(=O)CCC1=CC2=C(C=C1)OCO2)[NH+]3CCOCC3

Isomeric SMILES

CCC(CC)[C@H](CNC(=O)CCC1=CC2=C(C=C1)OCO2)[NH+]3CCOCC3

InChI

InChI=1S/C21H32N2O4/c1-3-17(4-2)18(23-9-11-25-12-10-23)14-22-21(24)8-6-16-5-7-19-20(13-16)27-15-26-19/h5,7,13,17-18H,3-4,6,8-12,14-15H2,1-2H3,(H,22,24)/p+1/t18-/m0/s1