propyl N-(1,3-benzodioxol-5-ylcarbonyl)-N'-(3-morpholin-4-ium-4-ylpropyl)carbamimidate

Systemtic Name: propyl N-(1,3-benzodioxol-5-ylcarbonyl)-N'-(3-morpholin-4-ium-4-ylpropyl)carbamimidate Openeye Name: N-[N-(3-morpholin-4-ium-4-ylpropyl)-C-propoxy-carbonimidoyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[1,3-benzodioxol-5-yl(oxo)methyl]-N'-[3-(4-morpholin-4-iumyl)propyl]carbamimidic acid propyl ester IUPAC Name: propyl N-(1,3-benzodioxole-5-carbonyl)-N'-(3-morpholin-4-ium-4-ylpropyl)carbamimidate Traditional Name: N-[N-(3-morpholin-4-ium-4-ylpropyl)-C-propoxy-carbonimidoyl]-piperonylamide Formula: C19H28N3O5+ MolecularWeight: 378.44272

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=NCCC[NH+]1CCOCC1)NC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCOC(=NCCC[NH+]1CCOCC1)NC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H27N3O5/c1-2-10-25-19(20-6-3-7-22-8-11-24-12-9-22)21-18(23)15-4-5-16-17(13-15)27-14-26-16/h4-5,13H,2-3,6-12,14H2,1H3,(H,20,21,23)/p+1