(4-cyanophenyl) 5-butyl-3-chloranyl-pyridine-2-carboxylate

Systemtic Name: (4-cyanophenyl) 5-butyl-3-chloranyl-pyridine-2-carboxylate Openeye Name: (4-cyanophenyl) 5-butyl-3-chloro-pyridine-2-carboxylate CAS Name: 5-butyl-3-chloro-2-pyridinecarboxylic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 5-butyl-3-chloropyridine-2-carboxylate Traditional Name: 5-butyl-3-chloro-picolinic acid (4-cyanophenyl) ester Formula: C17H15ClN2O2 MolecularWeight: 314.7662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(N=C1)C(=O)OC2=CC=C(C=C2)C#N)Cl

Isomeric SMILES

CCCCC1=CC(=C(N=C1)C(=O)OC2=CC=C(C=C2)C#N)Cl

InChI

InChI=1S/C17H15ClN2O2/c1-2-3-4-13-9-15(18)16(20-11-13)17(21)22-14-7-5-12(10-19)6-8-14/h5-9,11H,2-4H2,1H3