(2,4,6-trinitrophenyl) 2-(diphenylamino)-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)ethanimidate

Systemtic Name: (2,4,6-trinitrophenyl) 2-(diphenylamino)-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)ethanimidate Openeye Name: (2,4,6-trinitrophenyl) N-(2-oxo-2-piperazin-1-yl-ethyl)-2-(N-phenylanilino)ethanimidate CAS Name: N-[2-oxo-2-(1-piperazinyl)ethyl]-2-(N-phenylanilino)ethanimidic acid (2,4,6-trinitrophenyl) ester IUPAC Name: (2,4,6-trinitrophenyl) N-(2-oxo-2-piperazin-1-ylethyl)-2-(N-phenylanilino)ethanimidate Traditional Name: N-(2-keto-2-piperazino-ethyl)-2-(N-phenylanilino)acetimidic acid picryl ester Formula: C26H25N7O8 MolecularWeight: 563.5188

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)CN=C(CN(C2=CC=CC=C2)C3=CC=CC=C3)OC4=C(C=C(C=C4[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)C(=O)CN=C(CN(C2=CC=CC=C2)C3=CC=CC=C3)OC4=C(C=C(C=C4[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C26H25N7O8/c34-25(29-13-11-27-12-14-29)17-28-24(18-30(19-7-3-1-4-8-19)20-9-5-2-6-10-20)41-26-22(32(37)38)15-21(31(35)36)16-23(26)33(39)40/h1-10,15-16,27H,11-14,17-18H2