2-[[5-(2-chlorophenyl)-2-(3-methylphenyl)pyrazol-3-yl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[5-(2-chlorophenyl)-2-(3-methylphenyl)pyrazol-3-yl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[5-(2-chlorophenyl)-2-(m-tolyl)pyrazole-3-carbonyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[5-(2-chlorophenyl)-2-(3-methylphenyl)-3-pyrazolyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[5-(2-chlorophenyl)-2-(3-methylphenyl)pyrazole-3-carbonyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[5-(2-chlorophenyl)-2-(m-tolyl)pyrazole-3-carbonyl]amino]ethyl-dimethyl-ammonium Formula: C21H24ClN4O+ MolecularWeight: 383.89446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=CC(=N2)C3=CC=CC=C3Cl)C(=O)NCC[NH+](C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=CC(=N2)C3=CC=CC=C3Cl)C(=O)NCC[NH+](C)C

InChI

InChI=1S/C21H23ClN4O/c1-15-7-6-8-16(13-15)26-20(21(27)23-11-12-25(2)3)14-19(24-26)17-9-4-5-10-18(17)22/h4-10,13-14H,11-12H2,1-3H3,(H,23,27)/p+1