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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyridine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyridine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[2-(1-pyrrolidin-1-iumyl)ethyl]-3-pyridinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyridine-3-carboxamide Traditional Name: N-piperonyl-N-(2-pyrrolidin-1-ium-1-ylethyl)nicotinamide 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=CN=CC=C4

Isomeric SMILES

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

InChI

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