4-nitro-1-oxidanylidene-N-(phenylmethyl)-2H-pyridin-1-ium-2-amine

Systemtic Name: 4-nitro-1-oxidanylidene-N-(phenylmethyl)-2H-pyridin-1-ium-2-amine Openeye Name: N-benzyl-4-nitro-1-oxo-2H-pyridin-1-ium-2-amine CAS Name: 4-nitro-1-oxo-N-(phenylmethyl)-2H-pyridin-1-ium-2-amine IUPAC Name: N-benzyl-4-nitro-1-oxo-2H-pyridin-1-ium-2-amine Traditional Name: benzyl-(1-keto-4-nitro-2H-pyridin-1-ium-2-yl)amine Formula: C12H12N3O3+ MolecularWeight: 246.24198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2C=C(C=C[N+]2=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2C=C(C=C[N+]2=O)[N+](=O)[O-]

InChI

InChI=1S/C12H12N3O3/c16-14-7-6-11(15(17)18)8-12(14)13-9-10-4-2-1-3-5-10/h1-8,12-13H,9H2/q+1