2-hexadecylpyridine-3-carboxylic acid

Systemtic Name: 2-hexadecylpyridine-3-carboxylic acid Openeye Name: 2-hexadecylpyridine-3-carboxylic acid CAS Name: 2-hexadecyl-3-pyridinecarboxylic acid IUPAC Name: 2-hexadecylpyridine-3-carboxylic acid Traditional Name: 2-cetylnicotinic acid Formula: C22H37NO2 MolecularWeight: 347.53468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1=C(C=CC=N1)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC1=C(C=CC=N1)C(=O)O

InChI

InChI=1S/C22H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-20(22(24)25)17-16-19-23-21/h16-17,19H,2-15,18H2,1H3,(H,24,25)