heptyl 2-methylpyridine-4-carboxylate

Systemtic Name: heptyl 2-methylpyridine-4-carboxylate Openeye Name: heptyl 2-methylpyridine-4-carboxylate CAS Name: 2-methyl-4-pyridinecarboxylic acid heptyl ester IUPAC Name: heptyl 2-methylpyridine-4-carboxylate Traditional Name: 2-methylisonicotinic acid heptyl ester Formula: C14H21NO2 MolecularWeight: 235.32204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1=CC(=NC=C1)C

Isomeric SMILES

CCCCCCCOC(=O)C1=CC(=NC=C1)C

InChI

InChI=1S/C14H21NO2/c1-3-4-5-6-7-10-17-14(16)13-8-9-15-12(2)11-13/h8-9,11H,3-7,10H2,1-2H3