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

Systemtic Name: 2-[[2-(2-chlorophenyl)-5-(3,4-dimethylphenyl)pyrazol-3-yl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[2-(2-chlorophenyl)-5-(3,4-dimethylphenyl)pyrazole-3-carbonyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[2-(2-chlorophenyl)-5-(3,4-dimethylphenyl)-3-pyrazolyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[2-(2-chlorophenyl)-5-(3,4-dimethylphenyl)pyrazole-3-carbonyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[2-(2-chlorophenyl)-5-(3,4-dimethylphenyl)pyrazole-3-carbonyl]amino]ethyl-dimethyl-ammonium Formula: C22H26ClN4O+ MolecularWeight: 397.92104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=C2)C(=O)NCC[NH+](C)C)C3=CC=CC=C3Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=C2)C(=O)NCC[NH+](C)C)C3=CC=CC=C3Cl)C

InChI

InChI=1S/C22H25ClN4O/c1-15-9-10-17(13-16(15)2)19-14-21(22(28)24-11-12-26(3)4)27(25-19)20-8-6-5-7-18(20)23/h5-10,13-14H,11-12H2,1-4H3,(H,24,28)/p+1