4-(phenylmethyl)-N-[4-(trifluoromethyloxy)phenyl]piperazin-4-ium-1-carboxamide

Systemtic Name: 4-(phenylmethyl)-N-[4-(trifluoromethyloxy)phenyl]piperazin-4-ium-1-carboxamide Openeye Name: 4-benzyl-N-[4-(trifluoromethoxy)phenyl]piperazin-4-ium-1-carboxamide CAS Name: 4-(phenylmethyl)-N-[4-(trifluoromethoxy)phenyl]-1-piperazin-4-iumcarboxamide IUPAC Name: 4-benzyl-N-[4-(trifluoromethoxy)phenyl]piperazin-4-ium-1-carboxamide Traditional Name: 4-benzyl-N-[4-(trifluoromethoxy)phenyl]piperazin-4-ium-1-carboxamide Formula: C19H21F3N3O2+ MolecularWeight: 380.38415

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C19H20F3N3O2/c20-19(21,22)27-17-8-6-16(7-9-17)23-18(26)25-12-10-24(11-13-25)14-15-4-2-1-3-5-15/h1-9H,10-14H2,(H,23,26)/p+1