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

Systemtic Name: (3-bromophenyl)-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Openeye Name: (3-bromophenyl)-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]methanone CAS Name: (3-bromophenyl)-[4-[4-nitro-2-(trifluoromethyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (3-bromophenyl)-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Traditional Name: (3-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=C3)Br

Isomeric SMILES

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

InChI

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