1-methyl-4-(3-nitrophenyl)piperazin-1-ium

Systemtic Name: 1-methyl-4-(3-nitrophenyl)piperazin-1-ium Openeye Name: 1-methyl-4-(3-nitrophenyl)piperazin-1-ium CAS Name: 1-methyl-4-(3-nitrophenyl)piperazin-1-ium IUPAC Name: 1-methyl-4-(3-nitrophenyl)piperazin-1-ium Traditional Name: 1-methyl-4-(3-nitrophenyl)piperazin-1-ium Formula: C11H16N3O2+ MolecularWeight: 222.26364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15N3O2/c1-12-5-7-13(8-6-12)10-3-2-4-11(9-10)14(15)16/h2-4,9H,5-8H2,1H3/p+1