ethyl 4-hexyl-3-(phenylcarbonyl)-4H-pyridine-1-carboxylate

Systemtic Name: ethyl 4-hexyl-3-(phenylcarbonyl)-4H-pyridine-1-carboxylate Openeye Name: ethyl 3-benzoyl-4-hexyl-4H-pyridine-1-carboxylate CAS Name: 3-benzoyl-4-hexyl-4H-pyridine-1-carboxylic acid ethyl ester IUPAC Name: ethyl 3-benzoyl-4-hexyl-4H-pyridine-1-carboxylate Traditional Name: 3-benzoyl-4-hexyl-4H-pyridine-1-carboxylic acid ethyl ester Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C=CN(C=C1C(=O)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCCCCCC1C=CN(C=C1C(=O)C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C21H27NO3/c1-3-5-6-8-11-17-14-15-22(21(24)25-4-2)16-19(17)20(23)18-12-9-7-10-13-18/h7,9-10,12-17H,3-6,8,11H2,1-2H3