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

Systemtic Name: (5-bromanylnaphthalen-1-yl)-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Openeye Name: (5-bromo-1-naphthyl)-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone CAS Name: (5-bromo-1-naphthalenyl)-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (5-bromonaphthalen-1-yl)-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Traditional Name: (5-bromo-1-naphthyl)-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]methanone Formula: C22H17BrF3N3O3 MolecularWeight: 508.28789

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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=C3C=CC=C4Br

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)C3=CC=CC4=C3C=CC=C4Br

InChI

InChI=1S/C22H17BrF3N3O3/c23-18-6-2-3-15-16(18)4-1-5-17(15)21(30)28-11-9-27(10-12-28)19-8-7-14(22(24,25)26)13-20(19)29(31)32/h1-8,13H,9-12H2