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dodecanoyl pyridine-3-carboxylate

dodecanoyl pyridine-3-carboxylate

Systemtic Name:dodecanoyl pyridine-3-carboxylate
Openeye Name:dodecanoyl pyridine-3-carboxylate
CAS Name:3-pyridinecarboxylic acid 1-oxododecyl ester
IUPAC Name:dodecanoyl pyridine-3-carboxylate
Traditional Name:nicotinic acid lauroyl ester
Formula: C18H27NO3
MolecularWeight: 305.41188
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OC(=O)C1=CN=CC=C1


Isomeric SMILES

CCCCCCCCCCCC(=O)OC(=O)C1=CN=CC=C1


InChI

InChI=1S/C18H27NO3/c1-2-3-4-5-6-7-8-9-10-13-17(20)22-18(21)16-12-11-14-19-15-16/h11-12,14-15H,2-10,13H2,1H3


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