N'-(1,3-benzodioxol-5-ylmethyl)-N-(3-morpholin-4-ium-4-ylpropyl)butanediamide

Systemtic Name: N'-(1,3-benzodioxol-5-ylmethyl)-N-(3-morpholin-4-ium-4-ylpropyl)butanediamide Openeye Name: N'-(1,3-benzodioxol-5-ylmethyl)-N-(3-morpholin-4-ium-4-ylpropyl)butanediamide CAS Name: N'-(1,3-benzodioxol-5-ylmethyl)-N-[3-(4-morpholin-4-iumyl)propyl]butanediamide IUPAC Name: N'-(1,3-benzodioxol-5-ylmethyl)-N-(3-morpholin-4-ium-4-ylpropyl)butanediamide Traditional Name: N-(3-morpholin-4-ium-4-ylpropyl)-N'-piperonyl-succinamide Formula: C19H28N3O5+ MolecularWeight: 378.44272

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)CCC(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)CCC(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H27N3O5/c23-18(20-6-1-7-22-8-10-25-11-9-22)4-5-19(24)21-13-15-2-3-16-17(12-15)27-14-26-16/h2-3,12H,1,4-11,13-14H2,(H,20,23)(H,21,24)/p+1