N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-methylpiperazine-1,4-diium-1-yl)ethanamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-methylpiperazine-1,4-diium-1-yl)ethanamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-methylpiperazine-1,4-diium-1-yl)acetamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-methyl-1-piperazine-1,4-diiumyl)acetamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-methylpiperazine-1,4-diium-1-yl)acetamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-methylpiperazine-1,4-diium-1-yl)acetamide Formula: C15H19F6N3O+2 MolecularWeight: 371.321279

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C15H17F6N3O/c1-23-2-4-24(5-3-23)9-13(25)22-12-7-10(14(16,17)18)6-11(8-12)15(19,20)21/h6-8H,2-5,9H2,1H3,(H,22,25)/p+2