2-(4-methylpiperazine-1,4-diium-1-yl)-N-[(3-nitrophenyl)methylideneamino]ethanamide

Systemtic Name: 2-(4-methylpiperazine-1,4-diium-1-yl)-N-[(3-nitrophenyl)methylideneamino]ethanamide Openeye Name: 2-(4-methylpiperazine-1,4-diium-1-yl)-N-[(3-nitrophenyl)methyleneamino]acetamide CAS Name: 2-(4-methyl-1-piperazine-1,4-diiumyl)-N-[(3-nitrophenyl)methylideneamino]acetamide IUPAC Name: 2-(4-methylpiperazine-1,4-diium-1-yl)-N-[(3-nitrophenyl)methylideneamino]acetamide Traditional Name: 2-(4-methylpiperazine-1,4-diium-1-yl)-N-[(3-nitrobenzylidene)amino]acetamide Formula: C14H21N5O3+2 MolecularWeight: 307.34824

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CC(=O)NN=CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CC(=O)NN=CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H19N5O3/c1-17-5-7-18(8-6-17)11-14(20)16-15-10-12-3-2-4-13(9-12)19(21)22/h2-4,9-10H,5-8,11H2,1H3,(H,16,20)/p+2