3-(1,3-benzodioxol-5-yl)-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[[2-(1-pyrrolidinyl)-4-pyridin-1-iumyl]methyl]propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[(2-pyrrolidinopyridin-1-ium-4-yl)methyl]propionamide Formula: C20H24N3O3+ MolecularWeight: 354.42286

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=[NH+]C=CC(=C2)CNC(=O)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCN(C1)C2=[NH+]C=CC(=C2)CNC(=O)CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H23N3O3/c24-20(6-4-15-3-5-17-18(11-15)26-14-25-17)22-13-16-7-8-21-19(12-16)23-9-1-2-10-23/h3,5,7-8,11-12H,1-2,4,6,9-10,13-14H2,(H,22,24)/p+1