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

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-methyl-[2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-methyl-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-methyl-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-methyl-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]azanium Traditional Name: [2-keto-2-[3-(trifluoromethyl)anilino]ethyl]-methyl-piperonyl-ammonium Formula: C18H18F3N2O3+ MolecularWeight: 367.34233

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC2=C(C=C1)OCO2)CC(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C[NH+](CC1=CC2=C(C=C1)OCO2)CC(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H17F3N2O3/c1-23(9-12-5-6-15-16(7-12)26-11-25-15)10-17(24)22-14-4-2-3-13(8-14)18(19,20)21/h2-8H,9-11H2,1H3,(H,22,24)/p+1