N-[(Z)-[2-(4-methylpiperazin-4-ium-1-yl)-5-nitro-phenyl]methylideneamino]-4-nitro-benzamide

Systemtic Name: N-[(Z)-[2-(4-methylpiperazin-4-ium-1-yl)-5-nitro-phenyl]methylideneamino]-4-nitro-benzamide Openeye Name: N-[(Z)-[2-(4-methylpiperazin-4-ium-1-yl)-5-nitro-phenyl]methyleneamino]-4-nitro-benzamide CAS Name: N-[(Z)-[2-(4-methyl-1-piperazin-4-iumyl)-5-nitrophenyl]methylideneamino]-4-nitrobenzamide IUPAC Name: N-[(Z)-[2-(4-methylpiperazin-4-ium-1-yl)-5-nitrophenyl]methylideneamino]-4-nitrobenzamide Traditional Name: N-[(Z)-[2-(4-methylpiperazin-4-ium-1-yl)-5-nitro-benzylidene]amino]-4-nitro-benzamide Formula: C19H21N6O5+ MolecularWeight: 413.40724

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C=NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])/C=N\NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N6O5/c1-22-8-10-23(11-9-22)18-7-6-17(25(29)30)12-15(18)13-20-21-19(26)14-2-4-16(5-3-14)24(27)28/h2-7,12-13H,8-11H2,1H3,(H,21,26)/p+1/b20-13-