2-[2-(hydroxymethyl)-4-methyl-3-nitro-phenyl]pyridine-3-carboxylic acid

Systemtic Name: 2-[2-(hydroxymethyl)-4-methyl-3-nitro-phenyl]pyridine-3-carboxylic acid Openeye Name: 2-[2-(hydroxymethyl)-4-methyl-3-nitro-phenyl]pyridine-3-carboxylic acid CAS Name: 2-[2-(hydroxymethyl)-4-methyl-3-nitrophenyl]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-(hydroxymethyl)-4-methyl-3-nitrophenyl]pyridine-3-carboxylic acid Traditional Name: 2-(4-methyl-2-methylol-3-nitro-phenyl)nicotinic acid Formula: C14H12N2O5 MolecularWeight: 288.25548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C2=C(C=CC=N2)C(=O)O)CO)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=C(C=C1)C2=C(C=CC=N2)C(=O)O)CO)[N+](=O)[O-]

InChI

InChI=1S/C14H12N2O5/c1-8-4-5-9(11(7-17)13(8)16(20)21)12-10(14(18)19)3-2-6-15-12/h2-6,17H,7H2,1H3,(H,18,19)