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

Systemtic Name: (4-cyanophenyl) 3-chloranyl-5-nonyl-pyridine-2-carboxylate Openeye Name: (4-cyanophenyl) 3-chloro-5-nonyl-pyridine-2-carboxylate CAS Name: 3-chloro-5-nonyl-2-pyridinecarboxylic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 3-chloro-5-nonylpyridine-2-carboxylate Traditional Name: 3-chloro-5-nonyl-picolinic acid (4-cyanophenyl) ester Formula: C22H25ClN2O2 MolecularWeight: 384.8991

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC(=C(N=C1)C(=O)OC2=CC=C(C=C2)C#N)Cl

Isomeric SMILES

CCCCCCCCCC1=CC(=C(N=C1)C(=O)OC2=CC=C(C=C2)C#N)Cl

InChI

InChI=1S/C22H25ClN2O2/c1-2-3-4-5-6-7-8-9-18-14-20(23)21(25-16-18)22(26)27-19-12-10-17(15-24)11-13-19/h10-14,16H,2-9H2,1H3