5-(4-hexylphenyl)pyridine-2-carboxylic acid

Systemtic Name: 5-(4-hexylphenyl)pyridine-2-carboxylic acid Openeye Name: 5-(4-hexylphenyl)pyridine-2-carboxylic acid CAS Name: 5-(4-hexylphenyl)-2-pyridinecarboxylic acid IUPAC Name: 5-(4-hexylphenyl)pyridine-2-carboxylic acid Traditional Name: 5-(4-hexylphenyl)picolinic acid Formula: C18H21NO2 MolecularWeight: 283.36484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=CN=C(C=C2)C(=O)O

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=CN=C(C=C2)C(=O)O

InChI

InChI=1S/C18H21NO2/c1-2-3-4-5-6-14-7-9-15(10-8-14)16-11-12-17(18(20)21)19-13-16/h7-13H,2-6H2,1H3,(H,20,21)