1-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]pentan-1-one

Systemtic Name: 1-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]pentan-1-one Openeye Name: 1-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]pentan-1-one CAS Name: 1-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-1-pentanone IUPAC Name: 1-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]pentan-1-one Traditional Name: 1-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]pentan-1-one Formula: C16H20F3N3O3 MolecularWeight: 359.34351

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCCCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H20F3N3O3/c1-2-3-4-15(23)21-9-7-20(8-10-21)13-6-5-12(16(17,18)19)11-14(13)22(24)25/h5-6,11H,2-4,7-10H2,1H3