[2-[1,3-benzodioxol-5-ylmethyl(phenyl)amino]-2-oxidanylidene-ethyl]-dimethyl-azanium

Systemtic Name: [2-[1,3-benzodioxol-5-ylmethyl(phenyl)amino]-2-oxidanylidene-ethyl]-dimethyl-azanium Openeye Name: [2-[N-(1,3-benzodioxol-5-ylmethyl)anilino]-2-oxo-ethyl]-dimethyl-ammonium CAS Name: [2-[N-(1,3-benzodioxol-5-ylmethyl)anilino]-2-oxoethyl]-dimethylammonium IUPAC Name: [2-[N-(1,3-benzodioxol-5-ylmethyl)anilino]-2-oxoethyl]-dimethylazanium Traditional Name: [2-keto-2-(N-piperonylanilino)ethyl]-dimethyl-ammonium Formula: C18H21N2O3+ MolecularWeight: 313.37094

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC(=O)N(CC1=CC2=C(C=C1)OCO2)C3=CC=CC=C3

Isomeric SMILES

C[NH+](C)CC(=O)N(CC1=CC2=C(C=C1)OCO2)C3=CC=CC=C3

InChI

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