2-[[1-(3-chlorophenyl)-5-propan-2-yl-pyrazol-4-yl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[1-(3-chlorophenyl)-5-propan-2-yl-pyrazol-4-yl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[1-(3-chlorophenyl)-5-isopropyl-pyrazole-4-carbonyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[1-(3-chlorophenyl)-5-propan-2-yl-4-pyrazolyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[1-(3-chlorophenyl)-5-propan-2-ylpyrazole-4-carbonyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[1-(3-chlorophenyl)-5-isopropyl-pyrazole-4-carbonyl]amino]ethyl-dimethyl-ammonium Formula: C17H24ClN4O+ MolecularWeight: 335.85166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)NCC[NH+](C)C

Isomeric SMILES

CC(C)C1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)NCC[NH+](C)C

InChI

InChI=1S/C17H23ClN4O/c1-12(2)16-15(17(23)19-8-9-21(3)4)11-20-22(16)14-7-5-6-13(18)10-14/h5-7,10-12H,8-9H2,1-4H3,(H,19,23)/p+1