3-nitro-N-pyridin-1-ium-1-yl-benzamide

Systemtic Name: 3-nitro-N-pyridin-1-ium-1-yl-benzamide Openeye Name: 3-nitro-N-pyridin-1-ium-1-yl-benzamide CAS Name: 3-nitro-N-(1-pyridin-1-iumyl)benzamide IUPAC Name: 3-nitro-N-pyridin-1-ium-1-ylbenzamide Traditional Name: 3-nitro-N-pyridin-1-ium-1-yl-benzamide Formula: C12H10N3O3+ MolecularWeight: 244.2261

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9N3O3/c16-12(13-14-7-2-1-3-8-14)10-5-4-6-11(9-10)15(17)18/h1-9H/p+1