2-(3-nitrophenyl)carbonylpyridine-3-carboxylic acid

Systemtic Name: 2-(3-nitrophenyl)carbonylpyridine-3-carboxylic acid Openeye Name: 2-(3-nitrobenzoyl)pyridine-3-carboxylic acid CAS Name: 2-[(3-nitrophenyl)-oxomethyl]-3-pyridinecarboxylic acid IUPAC Name: 2-(3-nitrobenzoyl)pyridine-3-carboxylic acid Traditional Name: 2-(3-nitrobenzoyl)nicotinic acid Formula: C13H8N2O5 MolecularWeight: 272.21302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)C2=C(C=CC=N2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)C2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C13H8N2O5/c16-12(8-3-1-4-9(7-8)15(19)20)11-10(13(17)18)5-2-6-14-11/h1-7H,(H,17,18)