4-[(Z)-[3-(4-methylpiperazine-1,4-diium-1-yl)propanoylhydrazinylidene]methyl]-2-nitro-phenolate

Systemtic Name: 4-[(Z)-[3-(4-methylpiperazine-1,4-diium-1-yl)propanoylhydrazinylidene]methyl]-2-nitro-phenolate Openeye Name: 4-[(Z)-[3-(4-methylpiperazine-1,4-diium-1-yl)propanoylhydrazono]methyl]-2-nitro-phenolate CAS Name: 4-[(Z)-[[3-(4-methyl-1-piperazine-1,4-diiumyl)-1-oxopropyl]hydrazinylidene]methyl]-2-nitrophenolate IUPAC Name: 4-[(Z)-[3-(4-methylpiperazine-1,4-diium-1-yl)propanoylhydrazinylidene]methyl]-2-nitrophenolate Traditional Name: 4-[(Z)-[3-(4-methylpiperazine-1,4-diium-1-yl)propanoylhydrazono]methyl]-2-nitro-phenolate Formula: C15H22N5O4+ MolecularWeight: 336.36628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N5O4/c1-18-6-8-19(9-7-18)5-4-15(22)17-16-11-12-2-3-14(21)13(10-12)20(23)24/h2-3,10-11,21H,4-9H2,1H3,(H,17,22)/p+1/b16-11-