(4-chloranyl-3-nitro-phenyl)-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (4-chloranyl-3-nitro-phenyl)-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: (4-chloro-3-nitro-phenyl)-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: (4-chloro-3-nitrophenyl)-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: (4-chloro-3-nitrophenyl)-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: (4-chloro-3-nitro-phenyl)-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C12H15ClN3O3+ MolecularWeight: 284.7188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14ClN3O3/c1-14-4-6-15(7-5-14)12(17)9-2-3-10(13)11(8-9)16(18)19/h2-3,8H,4-7H2,1H3/p+1