N-(1,3-benzodioxol-5-ylmethyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyridine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyridine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyridine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[2-(1-pyrrolidin-1-iumyl)ethyl]-4-pyridinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyridine-4-carboxamide Traditional Name: N-piperonyl-N-(2-pyrrolidin-1-ium-1-ylethyl)isonicotinamide Formula: C20H24N3O3+ MolecularWeight: 354.42286

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCN(CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=NC=C4

Isomeric SMILES

C1CC[NH+](C1)CCN(CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=NC=C4

InChI

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