(phenylmethyl) 4-(3-cyanophenyl)-2,6-dimethyl-pyridine-3-carboxylate

Systemtic Name: (phenylmethyl) 4-(3-cyanophenyl)-2,6-dimethyl-pyridine-3-carboxylate Openeye Name: benzyl 4-(3-cyanophenyl)-2,6-dimethyl-pyridine-3-carboxylate CAS Name: 4-(3-cyanophenyl)-2,6-dimethyl-3-pyridinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(3-cyanophenyl)-2,6-dimethylpyridine-3-carboxylate Traditional Name: 4-(3-cyanophenyl)-2,6-dimethyl-nicotinic acid benzyl ester Formula: C22H18N2O2 MolecularWeight: 342.39052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)C2=CC=CC(=C2)C#N)C(=O)OCC3=CC=CC=C3)C

Isomeric SMILES

CC1=NC(=C(C(=C1)C2=CC=CC(=C2)C#N)C(=O)OCC3=CC=CC=C3)C

InChI

InChI=1S/C22H18N2O2/c1-15-11-20(19-10-6-9-18(12-19)13-23)21(16(2)24-15)22(25)26-14-17-7-4-3-5-8-17/h3-12H,14H2,1-2H3