N-[1,3-dimethyl-5-(phenylmethyl)-1,2,3-triazinan-2-ium-2-ylidene]nitramide

Systemtic Name: N-[1,3-dimethyl-5-(phenylmethyl)-1,2,3-triazinan-2-ium-2-ylidene]nitramide Openeye Name: N-(5-benzyl-1,3-dimethyl-triazinan-2-ium-2-ylidene)nitramide CAS Name: N-[1,3-dimethyl-5-(phenylmethyl)-2-triazinan-2-iumylidene]nitramide IUPAC Name: N-(5-benzyl-1,3-dimethyltriazinan-2-ium-2-ylidene)nitramide Traditional Name: N-(5-benzyl-1,3-dimethyl-triazinan-2-ium-2-ylidene)nitramide Formula: C12H18N5O2+ MolecularWeight: 264.30362

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(CN([N+]1=N[N+](=O)[O-])C)CC2=CC=CC=C2

Isomeric SMILES

CN1/[N+](=N\[N+](=O)[O-])/N(CC(C1)CC2=CC=CC=C2)C

InChI

InChI=1S/C12H18N5O2/c1-14-9-12(8-11-6-4-3-5-7-11)10-15(2)16(14)13-17(18)19/h3-7,12H,8-10H2,1-2H3/q+1/b16-13-