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

Systemtic Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]pyrimidine Openeye Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]pyrimidine CAS Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]pyrimidine IUPAC Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]pyrimidine Traditional Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]pyrimidine Formula: C15H14F3N5O2 MolecularWeight: 353.29917

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C3=NC=CC=N3

InChI

InChI=1S/C15H14F3N5O2/c16-15(17,18)11-2-3-12(13(10-11)23(24)25)21-6-8-22(9-7-21)14-19-4-1-5-20-14/h1-5,10H,6-9H2