3-(2-hexyldecyl)pyridine-4-carboxylate

Systemtic Name: 3-(2-hexyldecyl)pyridine-4-carboxylate Openeye Name: 3-(2-hexyldecyl)pyridine-4-carboxylate CAS Name: 3-(2-hexyldecyl)-4-pyridinecarboxylate IUPAC Name: 3-(2-hexyldecyl)pyridine-4-carboxylate Traditional Name: 3-(2-hexyldecyl)isonicotinate Formula: C22H36NO2- MolecularWeight: 346.52674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCCCC)CC1=C(C=CN=C1)C(=O)[O-]

Isomeric SMILES

CCCCCCCCC(CCCCCC)CC1=C(C=CN=C1)C(=O)[O-]

InChI

InChI=1S/C22H37NO2/c1-3-5-7-9-10-12-14-19(13-11-8-6-4-2)17-20-18-23-16-15-21(20)22(24)25/h15-16,18-19H,3-14,17H2,1-2H3,(H,24,25)/p-1