4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-aniline

Systemtic Name: 4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-aniline Openeye Name: 4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-aniline CAS Name: 4-(4-methyl-1-piperazin-4-iumyl)-3-nitroaniline IUPAC Name: 4-(4-methylpiperazin-4-ium-1-yl)-3-nitroaniline Traditional Name: [4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-phenyl]amine Formula: C11H17N4O2+ MolecularWeight: 237.27828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N4O2/c1-13-4-6-14(7-5-13)10-3-2-9(12)8-11(10)15(16)17/h2-3,8H,4-7,12H2,1H3/p+1