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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-(2-morpholin-4-ium-4-ylethyl)quinoline-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-(2-morpholin-4-ium-4-ylethyl)quinoline-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[2-(4-morpholin-4-iumyl)ethyl]-2-quinolinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-(2-morpholin-4-ium-4-ylethyl)quinoline-2-carboxamide Traditional Name: N-(2-morpholin-4-ium-4-ylethyl)-N-piperonyl-quinaldamide Formula: C24H26N3O4+ MolecularWeight: 420.48094

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCN(CC2=CC3=C(C=C2)OCO3)C(=O)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1COCC[NH+]1CCN(CC2=CC3=C(C=C2)OCO3)C(=O)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C24H25N3O4/c28-24(21-7-6-19-3-1-2-4-20(19)25-21)27(10-9-26-11-13-29-14-12-26)16-18-5-8-22-23(15-18)31-17-30-22/h1-8,15H,9-14,16-17H2/p+1