3-[(4-cyanophenyl)methyl]pyridine-4-carboxylic acid

Systemtic Name: 3-[(4-cyanophenyl)methyl]pyridine-4-carboxylic acid Openeye Name: 3-[(4-cyanophenyl)methyl]pyridine-4-carboxylic acid CAS Name: 3-[(4-cyanophenyl)methyl]-4-pyridinecarboxylic acid IUPAC Name: 3-[(4-cyanophenyl)methyl]pyridine-4-carboxylic acid Traditional Name: 3-(4-cyanobenzyl)isonicotinic acid Formula: C14H10N2O2 MolecularWeight: 238.2414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=C(C=CN=C2)C(=O)O)C#N

Isomeric SMILES

C1=CC(=CC=C1CC2=C(C=CN=C2)C(=O)O)C#N

InChI

InChI=1S/C14H10N2O2/c15-8-11-3-1-10(2-4-11)7-12-9-16-6-5-13(12)14(17)18/h1-6,9H,7H2,(H,17,18)