3-(3-nitrophenyl)pyridine-4-carboxylic acid

Systemtic Name: 3-(3-nitrophenyl)pyridine-4-carboxylic acid Openeye Name: 3-(3-nitrophenyl)pyridine-4-carboxylic acid CAS Name: 3-(3-nitrophenyl)-4-pyridinecarboxylic acid IUPAC Name: 3-(3-nitrophenyl)pyridine-4-carboxylic acid Traditional Name: 3-(3-nitrophenyl)isonicotinic acid Formula: C12H8N2O4 MolecularWeight: 244.20292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H8N2O4/c15-12(16)10-4-5-13-7-11(10)8-2-1-3-9(6-8)14(17)18/h1-7H,(H,15,16)