(2R)-N-(1,3-benzodioxol-5-yl)-2-(4-ethylpyridin-1-ium-1-yl)propanamide

Systemtic Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(4-ethylpyridin-1-ium-1-yl)propanamide Openeye Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(4-ethylpyridin-1-ium-1-yl)propanamide CAS Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(4-ethyl-1-pyridin-1-iumyl)propanamide IUPAC Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(4-ethylpyridin-1-ium-1-yl)propanamide Traditional Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(4-ethylpyridin-1-ium-1-yl)propionamide Formula: C17H19N2O3+ MolecularWeight: 299.34436

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=[N+](C=C1)C(C)C(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCC1=CC=[N+](C=C1)[C@H](C)C(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H18N2O3/c1-3-13-6-8-19(9-7-13)12(2)17(20)18-14-4-5-15-16(10-14)22-11-21-15/h4-10,12H,3,11H2,1-2H3/p+1/t12-/m1/s1