ethyl pyridine-3-carboxylate; pyridine-3-carboxylate

Systemtic Name: ethyl pyridine-3-carboxylate; pyridine-3-carboxylate Openeye Name: ethyl pyridine-3-carboxylate; pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylate; 3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl pyridine-3-carboxylate; pyridine-3-carboxylate Traditional Name: nicotinate; nicotinic acid ethyl ester Formula: C14H13N2O4- MolecularWeight: 273.26402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=CC=C1.C1=CC(=CN=C1)C(=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CN=CC=C1.C1=CC(=CN=C1)C(=O)[O-]

InChI

InChI=1S/C8H9NO2.C6H5NO2/c1-2-11-8(10)7-4-3-5-9-6-7;8-6(9)5-2-1-3-7-4-5/h3-6H,2H2,1H3;1-4H,(H,8,9)/p-1