2-methyl-4-nitro-5-piperazin-4-ium-1-yl-aniline

Systemtic Name: 2-methyl-4-nitro-5-piperazin-4-ium-1-yl-aniline Openeye Name: 2-methyl-4-nitro-5-piperazin-4-ium-1-yl-aniline CAS Name: 2-methyl-4-nitro-5-(1-piperazin-4-iumyl)aniline IUPAC Name: 2-methyl-4-nitro-5-piperazin-4-ium-1-ylaniline Traditional Name: (2-methyl-4-nitro-5-piperazin-4-ium-1-yl-phenyl)amine Formula: C11H17N4O2+ MolecularWeight: 237.27828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1N)N2CC[NH2+]CC2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1N)N2CC[NH2+]CC2)[N+](=O)[O-]

InChI

InChI=1S/C11H16N4O2/c1-8-6-11(15(16)17)10(7-9(8)12)14-4-2-13-3-5-14/h6-7,13H,2-5,12H2,1H3/p+1