1-methyl-1-(3-nitrophenyl)piperazin-1-ium

Systemtic Name: 1-methyl-1-(3-nitrophenyl)piperazin-1-ium Openeye Name: 1-methyl-1-(3-nitrophenyl)piperazin-1-ium CAS Name: 1-methyl-1-(3-nitrophenyl)piperazin-1-ium IUPAC Name: 1-methyl-1-(3-nitrophenyl)piperazin-1-ium Traditional Name: 1-methyl-1-(3-nitrophenyl)piperazin-1-ium Formula: C11H16N3O2+ MolecularWeight: 222.26364

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCNCC1)C2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

C[N+]1(CCNCC1)C2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H16N3O2/c1-14(7-5-12-6-8-14)11-4-2-3-10(9-11)13(15)16/h2-4,9,12H,5-8H2,1H3/q+1