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

Systemtic Name: (2-bromophenyl)-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Openeye Name: (2-bromophenyl)-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]methanone CAS Name: (2-bromophenyl)-[4-[4-nitro-2-(trifluoromethyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (2-bromophenyl)-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Traditional Name: (2-bromophenyl)-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazino]methanone Formula: C18H15BrF3N3O3 MolecularWeight: 458.22921

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F)C(=O)C3=CC=CC=C3Br

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F)C(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C18H15BrF3N3O3/c19-15-4-2-1-3-13(15)17(26)24-9-7-23(8-10-24)16-6-5-12(25(27)28)11-14(16)18(20,21)22/h1-6,11H,7-10H2