4-(diphenylmethyl)-N-[2-(trifluoromethyl)phenyl]piperazin-4-ium-1-carboxamide

Systemtic Name: 4-(diphenylmethyl)-N-[2-(trifluoromethyl)phenyl]piperazin-4-ium-1-carboxamide Openeye Name: 4-benzhydryl-N-[2-(trifluoromethyl)phenyl]piperazin-4-ium-1-carboxamide CAS Name: 4-(diphenylmethyl)-N-[2-(trifluoromethyl)phenyl]-1-piperazin-4-iumcarboxamide IUPAC Name: 4-benzhydryl-N-[2-(trifluoromethyl)phenyl]piperazin-4-ium-1-carboxamide Traditional Name: 4-benzhydryl-N-[2-(trifluoromethyl)phenyl]piperazin-4-ium-1-carboxamide Formula: C25H25F3N3O+ MolecularWeight: 440.48071

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C25H24F3N3O/c26-25(27,28)21-13-7-8-14-22(21)29-24(32)31-17-15-30(16-18-31)23(19-9-3-1-4-10-19)20-11-5-2-6-12-20/h1-14,23H,15-18H2,(H,29,32)/p+1