(2-nitrophenyl)-piperazin-4-ium-1-yl-methanone

Systemtic Name: (2-nitrophenyl)-piperazin-4-ium-1-yl-methanone Openeye Name: (2-nitrophenyl)-piperazin-4-ium-1-yl-methanone CAS Name: (2-nitrophenyl)-(1-piperazin-4-iumyl)methanone IUPAC Name: (2-nitrophenyl)-piperazin-4-ium-1-ylmethanone Traditional Name: (2-nitrophenyl)-piperazin-4-ium-1-yl-methanone Formula: C11H14N3O3+ MolecularWeight: 236.24716

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH2+]1)C(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C11H13N3O3/c15-11(13-7-5-12-6-8-13)9-3-1-2-4-10(9)14(16)17/h1-4,12H,5-8H2/p+1