2-ethoxycarbonyl-4-ethyl-pyridine-3-carboxylic acid

Systemtic Name: 2-ethoxycarbonyl-4-ethyl-pyridine-3-carboxylic acid Openeye Name: 2-ethoxycarbonyl-4-ethyl-pyridine-3-carboxylic acid CAS Name: 2-ethoxycarbonyl-4-ethyl-3-pyridinecarboxylic acid IUPAC Name: 2-ethoxycarbonyl-4-ethylpyridine-3-carboxylic acid Traditional Name: 2-carbethoxy-4-ethyl-nicotinic acid Formula: C11H13NO4 MolecularWeight: 223.22522

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC=C1)C(=O)OCC)C(=O)O

Isomeric SMILES

CCC1=C(C(=NC=C1)C(=O)OCC)C(=O)O

InChI

InChI=1S/C11H13NO4/c1-3-7-5-6-12-9(8(7)10(13)14)11(15)16-4-2/h5-6H,3-4H2,1-2H3,(H,13,14)