(E)-1-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]but-2-en-1-one

Systemtic Name: (E)-1-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]but-2-en-1-one Openeye Name: (E)-1-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]but-2-en-1-one CAS Name: (E)-1-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-2-buten-1-one IUPAC Name: (E)-1-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]but-2-en-1-one Traditional Name: (E)-1-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]but-2-en-1-one Formula: C15H16F3N3O3 MolecularWeight: 343.30105

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16F3N3O3/c1-2-3-14(22)20-8-6-19(7-9-20)12-5-4-11(15(16,17)18)10-13(12)21(23)24/h2-5,10H,6-9H2,1H3/b3-2+