ethyl 5-butyl-4-chloranyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-butyl-4-chloranyl-pyridine-3-carboxylate Openeye Name: ethyl 5-butyl-4-chloro-pyridine-3-carboxylate CAS Name: 5-butyl-4-chloro-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-butyl-4-chloropyridine-3-carboxylate Traditional Name: 5-butyl-4-chloro-nicotinic acid ethyl ester Formula: C12H16ClNO2 MolecularWeight: 241.71394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=CN=C1)C(=O)OCC)Cl

Isomeric SMILES

CCCCC1=C(C(=CN=C1)C(=O)OCC)Cl

InChI

InChI=1S/C12H16ClNO2/c1-3-5-6-9-7-14-8-10(11(9)13)12(15)16-4-2/h7-8H,3-6H2,1-2H3