[4-[(1,3-benzodioxol-5-ylcarbonylamino)methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [4-[(1,3-benzodioxol-5-ylcarbonylamino)methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [4-[(1,3-benzodioxole-5-carbonylamino)methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [4-[[[1,3-benzodioxol-5-yl(oxo)methyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [4-[(1,3-benzodioxole-5-carbonylamino)methyl]phenyl]methyl-dimethylazanium Traditional Name: dimethyl-[4-[(piperonyloylamino)methyl]benzyl]ammonium Formula: C18H21N2O3+ MolecularWeight: 313.37094

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[NH+](C)CC1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H20N2O3/c1-20(2)11-14-5-3-13(4-6-14)10-19-18(21)15-7-8-16-17(9-15)23-12-22-16/h3-9H,10-12H2,1-2H3,(H,19,21)/p+1