4-chloranyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 4-chloranyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-(trifluoromethyl)phenyl]benzamide Openeye Name: 4-chloro-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-(trifluoromethyl)phenyl]benzamide CAS Name: 4-chloro-N-[2-(4-methyl-1-piperazin-4-iumyl)-5-(trifluoromethyl)phenyl]benzamide IUPAC Name: 4-chloro-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-(trifluoromethyl)phenyl]benzamide Traditional Name: 4-chloro-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-(trifluoromethyl)phenyl]benzamide Formula: C19H20ClF3N3O+ MolecularWeight: 398.82981

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H19ClF3N3O/c1-25-8-10-26(11-9-25)17-7-4-14(19(21,22)23)12-16(17)24-18(27)13-2-5-15(20)6-3-13/h2-7,12H,8-11H2,1H3,(H,24,27)/p+1