(Z)-[2-nitro-4-(trifluoromethyl)phenoxy]imino-oxidanidyl-(4-phenylpiperazin-1-yl)azanium

Systemtic Name: (Z)-[2-nitro-4-(trifluoromethyl)phenoxy]imino-oxidanidyl-(4-phenylpiperazin-1-yl)azanium Openeye Name: (Z)-[2-nitro-4-(trifluoromethyl)phenoxy]imino-oxido-(4-phenylpiperazin-1-yl)ammonium CAS Name: (Z)-[2-nitro-4-(trifluoromethyl)phenoxy]imino-oxido-(4-phenyl-1-piperazinyl)ammonium IUPAC Name: (Z)-[2-nitro-4-(trifluoromethyl)phenoxy]imino-oxido-(4-phenylpiperazin-1-yl)azanium Traditional Name: (Z)-[2-nitro-4-(trifluoromethyl)phenyl]oximino-oxido-(4-phenylpiperazino)ammonium Formula: C17H16F3N5O4 MolecularWeight: 411.33525

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)[N+](=NOC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)/[N+](=N/OC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])/[O-]

InChI

InChI=1S/C17H16F3N5O4/c18-17(19,20)13-6-7-16(15(12-13)24(26)27)29-21-25(28)23-10-8-22(9-11-23)14-4-2-1-3-5-14/h1-7,12H,8-11H2/b25-21-