N-(4,6-dimethylpyridin-1-ium-2-yl)-3-nitro-benzamide

Systemtic Name: N-(4,6-dimethylpyridin-1-ium-2-yl)-3-nitro-benzamide Openeye Name: N-(4,6-dimethylpyridin-1-ium-2-yl)-3-nitro-benzamide CAS Name: N-(4,6-dimethyl-2-pyridin-1-iumyl)-3-nitrobenzamide IUPAC Name: N-(4,6-dimethylpyridin-1-ium-2-yl)-3-nitrobenzamide Traditional Name: N-(4,6-dimethylpyridin-1-ium-2-yl)-3-nitro-benzamide Formula: C14H14N3O3+ MolecularWeight: 272.27926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=[NH+]C(=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C14H13N3O3/c1-9-6-10(2)15-13(7-9)16-14(18)11-4-3-5-12(8-11)17(19)20/h3-8H,1-2H3,(H,15,16,18)/p+1