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3-[1,3-benzodioxol-5-ylmethyl(cyclohexylcarbamoyl)amino]propyl-dimethyl-azanium

3-[1,3-benzodioxol-5-ylmethyl(cyclohexylcarbamoyl)amino]propyl-dimethyl-azanium

Systemtic Name:3-[1,3-benzodioxol-5-ylmethyl(cyclohexylcarbamoyl)amino]propyl-dimethyl-azanium
Openeye Name:3-[1,3-benzodioxol-5-ylmethyl(cyclohexylcarbamoyl)amino]propyl-dimethyl-ammonium
CAS Name:3-[1,3-benzodioxol-5-ylmethyl-[(cyclohexylamino)-oxomethyl]amino]propyl-dimethylammonium
IUPAC Name:3-[1,3-benzodioxol-5-ylmethyl(cyclohexylcarbamoyl)amino]propyl-dimethylazanium
Traditional Name:3-[cyclohexylcarbamoyl(piperonyl)amino]propyl-dimethyl-ammonium
Formula: C20H32N3O3+
MolecularWeight: 362.48638
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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN(CC1=CC2=C(C=C1)OCO2)C(=O)NC3CCCCC3


Isomeric SMILES

C[NH+](C)CCCN(CC1=CC2=C(C=C1)OCO2)C(=O)NC3CCCCC3


InChI

InChI=1S/C20H31N3O3/c1-22(2)11-6-12-23(20(24)21-17-7-4-3-5-8-17)14-16-9-10-18-19(13-16)26-15-25-18/h9-10,13,17H,3-8,11-12,14-15H2,1-2H3,(H,21,24)/p+1


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