N-[2-chloranyl-5-(trifluoromethyl)phenyl]-2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-[2-chloranyl-5-(trifluoromethyl)phenyl]-2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide CAS Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide Formula: C20H23ClF3N3O+2 MolecularWeight: 413.86433

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC=CC=C2)CC(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC=CC=C2)CC(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C20H21ClF3N3O/c21-17-7-6-16(20(22,23)24)12-18(17)25-19(28)14-27-10-8-26(9-11-27)13-15-4-2-1-3-5-15/h1-7,12H,8-11,13-14H2,(H,25,28)/p+2