3-[2-(1,3-benzodioxol-5-ylmethylamino)benzimidazol-1-yl]propyl-dimethyl-azanium

Systemtic Name: 3-[2-(1,3-benzodioxol-5-ylmethylamino)benzimidazol-1-yl]propyl-dimethyl-azanium Openeye Name: 3-[2-(1,3-benzodioxol-5-ylmethylamino)benzimidazol-1-yl]propyl-dimethyl-ammonium CAS Name: 3-[2-(1,3-benzodioxol-5-ylmethylamino)-1-benzimidazolyl]propyl-dimethylammonium IUPAC Name: 3-[2-(1,3-benzodioxol-5-ylmethylamino)benzimidazol-1-yl]propyl-dimethylazanium Traditional Name: dimethyl-[3-[2-(piperonylamino)benzimidazol-1-yl]propyl]ammonium Formula: C20H25N4O2+ MolecularWeight: 353.4381

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN1C2=CC=CC=C2N=C1NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C[NH+](C)CCCN1C2=CC=CC=C2N=C1NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H24N4O2/c1-23(2)10-5-11-24-17-7-4-3-6-16(17)22-20(24)21-13-15-8-9-18-19(12-15)26-14-25-18/h3-4,6-9,12H,5,10-11,13-14H2,1-2H3,(H,21,22)/p+1