5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-N-(1-methylpiperidin-1-ium-1-yl)pyrazole-3-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-N-(1-methylpiperidin-1-ium-1-yl)pyrazole-3-carboxamide Openeye Name: 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-N-(1-methylpiperidin-1-ium-1-yl)pyrazole-3-carboxamide CAS Name: 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-N-(1-methyl-1-piperidin-1-iumyl)-3-pyrazolecarboxamide IUPAC Name: 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-N-(1-methylpiperidin-1-ium-1-yl)pyrazole-3-carboxamide Traditional Name: 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-N-(1-methylpiperidin-1-ium-1-yl)pyrazole-3-carboxamide Formula: C23H24Cl3N4O+ MolecularWeight: 478.82186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C(=O)N[N+]2(CCCCC2)C)C3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(N(N=C1C(=O)N[N+]2(CCCCC2)C)C3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H23Cl3N4O/c1-15-21(23(31)28-30(2)12-4-3-5-13-30)27-29(20-11-10-18(25)14-19(20)26)22(15)16-6-8-17(24)9-7-16/h6-11,14H,3-5,12-13H2,1-2H3/p+1