2-[2-(hydroxymethyl)-3-nitro-phenyl]pyridine-3-carboxylic acid

Systemtic Name: 2-[2-(hydroxymethyl)-3-nitro-phenyl]pyridine-3-carboxylic acid Openeye Name: 2-[2-(hydroxymethyl)-3-nitro-phenyl]pyridine-3-carboxylic acid CAS Name: 2-[2-(hydroxymethyl)-3-nitrophenyl]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-(hydroxymethyl)-3-nitrophenyl]pyridine-3-carboxylic acid Traditional Name: 2-(2-methylol-3-nitro-phenyl)nicotinic acid Formula: C13H10N2O5 MolecularWeight: 274.2289

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10N2O5/c16-7-10-8(3-1-5-11(10)15(19)20)12-9(13(17)18)4-2-6-14-12/h1-6,16H,7H2,(H,17,18)