N-(1,3-benzodioxol-5-yl)-1-[(2-oxidanylidene-3-propyl-benzimidazol-1-yl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[(2-oxidanylidene-3-propyl-benzimidazol-1-yl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[(2-oxo-3-propyl-benzimidazol-1-yl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[(2-oxo-3-propyl-1-benzimidazolyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[(2-oxo-3-propylbenzimidazol-1-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[(2-keto-3-propyl-benzimidazol-1-yl)methyl]piperidin-1-ium-4-carboxamide Formula: C24H29N4O4+ MolecularWeight: 437.51146

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N(C1=O)C[NH+]3CCC(CC3)C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCN1C2=CC=CC=C2N(C1=O)C[NH+]3CCC(CC3)C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H28N4O4/c1-2-11-27-19-5-3-4-6-20(19)28(24(27)30)15-26-12-9-17(10-13-26)23(29)25-18-7-8-21-22(14-18)32-16-31-21/h3-8,14,17H,2,9-13,15-16H2,1H3,(H,25,29)/p+1