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

Systemtic Name: 2-[[1-(3-chlorophenyl)-5-ethyl-3-propyl-pyrazol-4-yl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[1-(3-chlorophenyl)-5-ethyl-3-propyl-pyrazole-4-carbonyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[1-(3-chlorophenyl)-5-ethyl-3-propyl-4-pyrazolyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[1-(3-chlorophenyl)-5-ethyl-3-propylpyrazole-4-carbonyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[1-(3-chlorophenyl)-5-ethyl-3-propyl-pyrazole-4-carbonyl]amino]ethyl-dimethyl-ammonium Formula: C19H28ClN4O+ MolecularWeight: 363.90482

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1C(=O)NCC[NH+](C)C)CC)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCCC1=NN(C(=C1C(=O)NCC[NH+](C)C)CC)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C19H27ClN4O/c1-5-8-16-18(19(25)21-11-12-23(3)4)17(6-2)24(22-16)15-10-7-9-14(20)13-15/h7,9-10,13H,5-6,8,11-12H2,1-4H3,(H,21,25)/p+1