2-(2-hexyldecyl)pyridine-3-carboxylate

Systemtic Name: 2-(2-hexyldecyl)pyridine-3-carboxylate Openeye Name: 2-(2-hexyldecyl)pyridine-3-carboxylate CAS Name: 2-(2-hexyldecyl)-3-pyridinecarboxylate IUPAC Name: 2-(2-hexyldecyl)pyridine-3-carboxylate Traditional Name: 2-(2-hexyldecyl)nicotinate Formula: C22H36NO2- MolecularWeight: 346.52674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCCCC)CC1=C(C=CC=N1)C(=O)[O-]

Isomeric SMILES

CCCCCCCCC(CCCCCC)CC1=C(C=CC=N1)C(=O)[O-]

InChI

InChI=1S/C22H37NO2/c1-3-5-7-9-10-12-15-19(14-11-8-6-4-2)18-21-20(22(24)25)16-13-17-23-21/h13,16-17,19H,3-12,14-15,18H2,1-2H3,(H,24,25)/p-1