1-methyl-4-nitroso-1-(phenylmethyl)piperazin-1-ium chloride

Systemtic Name: 1-methyl-4-nitroso-1-(phenylmethyl)piperazin-1-ium chloride Openeye Name: 1-benzyl-1-methyl-4-nitroso-piperazin-1-ium chloride CAS Name: 1-methyl-4-nitroso-1-(phenylmethyl)piperazin-1-ium chloride IUPAC Name: 1-benzyl-1-methyl-4-nitrosopiperazin-1-ium chloride Traditional Name: 1-benzyl-1-methyl-4-nitroso-piperazin-1-ium chloride Formula: C12H18ClN3O MolecularWeight: 255.74382

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(CC1)N=O)CC2=CC=CC=C2.[Cl-]

Isomeric SMILES

C[N+]1(CCN(CC1)N=O)CC2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C12H18N3O.ClH/c1-15(9-7-14(13-16)8-10-15)11-12-5-3-2-4-6-12;/h2-6H,7-11H2,1H3;1H/q+1;/p-1