naphthalen-1-yl-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone

Systemtic Name: naphthalen-1-yl-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Openeye Name: 1-naphthyl-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone CAS Name: 1-naphthalenyl-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]methanone IUPAC Name: naphthalen-1-yl-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Traditional Name: 1-naphthyl-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]methanone Formula: C22H18F3N3O3 MolecularWeight: 429.39183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H18F3N3O3/c23-22(24,25)16-8-9-19(20(14-16)28(30)31)26-10-12-27(13-11-26)21(29)18-7-3-5-15-4-1-2-6-17(15)18/h1-9,14H,10-13H2