(Z)-(4-ethoxycarbonylpiperazin-1-yl)-(5-fluoranyl-2,4-dinitro-phenoxy)imino-oxidanidyl-azanium

Systemtic Name: (Z)-(4-ethoxycarbonylpiperazin-1-yl)-(5-fluoranyl-2,4-dinitro-phenoxy)imino-oxidanidyl-azanium Openeye Name: (Z)-(4-ethoxycarbonylpiperazin-1-yl)-(5-fluoro-2,4-dinitro-phenoxy)imino-oxido-ammonium CAS Name: (Z)-(4-ethoxycarbonyl-1-piperazinyl)-(5-fluoro-2,4-dinitrophenoxy)imino-oxidoammonium IUPAC Name: (Z)-(4-ethoxycarbonylpiperazin-1-yl)-(5-fluoro-2,4-dinitrophenoxy)imino-oxidoazanium Traditional Name: (Z)-(4-carbethoxypiperazino)-(5-fluoro-2,4-dinitro-phenyl)oximino-oxido-ammonium Formula: C13H15FN6O8 MolecularWeight: 402.292003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)[N+](=NOC2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])F)[O-]

Isomeric SMILES

CCOC(=O)N1CCN(CC1)/[N+](=N/OC2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])F)/[O-]

InChI

InChI=1S/C13H15FN6O8/c1-2-27-13(21)16-3-5-17(6-4-16)20(26)15-28-12-7-9(14)10(18(22)23)8-11(12)19(24)25/h7-8H,2-6H2,1H3/b20-15-