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

Systemtic Name: 2-[[2-(4-chlorophenyl)-5-phenyl-pyrazol-3-yl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[2-(4-chlorophenyl)-5-phenyl-pyrazole-3-carbonyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[2-(4-chlorophenyl)-5-phenyl-3-pyrazolyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[2-(4-chlorophenyl)-5-phenylpyrazole-3-carbonyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[2-(4-chlorophenyl)-5-phenyl-pyrazole-3-carbonyl]amino]ethyl-dimethyl-ammonium Formula: C20H22ClN4O+ MolecularWeight: 369.86788

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)C1=CC(=NN1C2=CC=C(C=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

C[NH+](C)CCNC(=O)C1=CC(=NN1C2=CC=C(C=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C20H21ClN4O/c1-24(2)13-12-22-20(26)19-14-18(15-6-4-3-5-7-15)23-25(19)17-10-8-16(21)9-11-17/h3-11,14H,12-13H2,1-2H3,(H,22,26)/p+1