2-octadecylpyridine-3-carboxylate

Systemtic Name: 2-octadecylpyridine-3-carboxylate Openeye Name: 2-octadecylpyridine-3-carboxylate CAS Name: 2-octadecyl-3-pyridinecarboxylate IUPAC Name: 2-octadecylpyridine-3-carboxylate Traditional Name: 2-stearylnicotinate Formula: C24H40NO2- MolecularWeight: 374.5799

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=C(C=CC=N1)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=C(C=CC=N1)C(=O)[O-]

InChI

InChI=1S/C24H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23-22(24(26)27)19-18-21-25-23/h18-19,21H,2-17,20H2,1H3,(H,26,27)/p-1