5-nitro-2-propan-2-yl-pyridine-3-carboxylic acid

Systemtic Name: 5-nitro-2-propan-2-yl-pyridine-3-carboxylic acid Openeye Name: 2-isopropyl-5-nitro-pyridine-3-carboxylic acid CAS Name: 5-nitro-2-propan-2-yl-3-pyridinecarboxylic acid IUPAC Name: 5-nitro-2-propan-2-ylpyridine-3-carboxylic acid Traditional Name: 2-isopropyl-5-nitro-nicotinic acid Formula: C9H10N2O4 MolecularWeight: 210.1867

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC=C(C=C1C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=NC=C(C=C1C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C9H10N2O4/c1-5(2)8-7(9(12)13)3-6(4-10-8)11(14)15/h3-5H,1-2H3,(H,12,13)