(E)-[4-(2-acetyloxyphenyl)carbonylpiperazin-1-yl]-(2,4-dinitrophenoxy)imino-oxidanidyl-azanium

Systemtic Name: (E)-[4-(2-acetyloxyphenyl)carbonylpiperazin-1-yl]-(2,4-dinitrophenoxy)imino-oxidanidyl-azanium Openeye Name: (E)-[4-(2-acetoxybenzoyl)piperazin-1-yl]-(2,4-dinitrophenoxy)imino-oxido-ammonium CAS Name: (E)-[4-[(2-acetyloxyphenyl)-oxomethyl]-1-piperazinyl]-(2,4-dinitrophenoxy)imino-oxidoammonium IUPAC Name: (E)-[4-(2-acetyloxybenzoyl)piperazin-1-yl]-(2,4-dinitrophenoxy)imino-oxidoazanium Traditional Name: (E)-[4-(2-acetoxybenzoyl)piperazino]-(2,4-dinitrophenyl)oximino-oxido-ammonium Formula: C19H18N6O9 MolecularWeight: 474.38102

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)N2CCN(CC2)[N+](=NOC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])[O-]

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)N2CCN(CC2)/[N+](=N\OC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])/[O-]

InChI

InChI=1S/C19H18N6O9/c1-13(26)33-17-5-3-2-4-15(17)19(27)21-8-10-22(11-9-21)25(32)20-34-18-7-6-14(23(28)29)12-16(18)24(30)31/h2-7,12H,8-11H2,1H3/b25-20+