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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-(2-morpholin-4-ium-4-ylethyl)pyridine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-(2-morpholin-4-ium-4-ylethyl)pyridine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[2-(4-morpholin-4-iumyl)ethyl]-4-pyridinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-(2-morpholin-4-ium-4-ylethyl)pyridine-4-carboxamide Traditional Name: N-(2-morpholin-4-ium-4-ylethyl)-N-piperonyl-isonicotinamide Formula: C20H24N3O4+ MolecularWeight: 370.42226

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCN(CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=NC=C4

Isomeric SMILES

C1COCC[NH+]1CCN(CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=NC=C4

InChI

InChI=1S/C20H23N3O4/c24-20(17-3-5-21-6-4-17)23(8-7-22-9-11-25-12-10-22)14-16-1-2-18-19(13-16)27-15-26-18/h1-6,13H,7-12,14-15H2/p+1