2-[[(1,3-benzodioxol-5-ylcarbonylamino)-propoxy-methylidene]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(1,3-benzodioxol-5-ylcarbonylamino)-propoxy-methylidene]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[(1,3-benzodioxole-5-carbonylamino)-propoxy-methylene]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-propoxymethylidene]amino]ethyl-dimethylammonium IUPAC Name: 2-[[(1,3-benzodioxole-5-carbonylamino)-propoxymethylidene]amino]ethyl-dimethylazanium Traditional Name: dimethyl-[2-[[(piperonyloylamino)-propoxy-methylene]amino]ethyl]ammonium Formula: C16H24N3O4+ MolecularWeight: 322.37946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=NCC[NH+](C)C)NC(=O)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCCOC(=NCC[NH+](C)C)NC(=O)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C16H23N3O4/c1-4-9-21-16(17-7-8-19(2)3)18-15(20)12-5-6-13-14(10-12)23-11-22-13/h5-6,10H,4,7-9,11H2,1-3H3,(H,17,18,20)/p+1