[4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-phenyl-methanone Openeye Name: [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-phenylmethanone Traditional Name: [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazino]-phenyl-methanone Formula: C18H15F3N4O5 MolecularWeight: 424.33071

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15F3N4O5/c19-18(20,21)13-10-14(24(27)28)16(15(11-13)25(29)30)22-6-8-23(9-7-22)17(26)12-4-2-1-3-5-12/h1-5,10-11H,6-9H2