3-[[(1,3-benzodioxol-5-ylcarbonylamino)-propan-2-yloxy-methylidene]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(1,3-benzodioxol-5-ylcarbonylamino)-propan-2-yloxy-methylidene]amino]propyl-dimethyl-azanium Openeye Name: 3-[[(1,3-benzodioxole-5-carbonylamino)-isopropoxy-methylene]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-propan-2-yloxymethylidene]amino]propyl-dimethylammonium IUPAC Name: 3-[[(1,3-benzodioxole-5-carbonylamino)-propan-2-yloxymethylidene]amino]propyl-dimethylazanium Traditional Name: 3-[[isopropoxy-(piperonyloylamino)methylene]amino]propyl-dimethyl-ammonium Formula: C17H26N3O4+ MolecularWeight: 336.40604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=NCCC[NH+](C)C)NC(=O)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(C)OC(=NCCC[NH+](C)C)NC(=O)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C17H25N3O4/c1-12(2)24-17(18-8-5-9-20(3)4)19-16(21)13-6-7-14-15(10-13)23-11-22-14/h6-7,10,12H,5,8-9,11H2,1-4H3,(H,18,19,21)/p+1