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pyridin-2-ylsulfonyl octanoate

pyridin-2-ylsulfonyl octanoate

Systemtic Name:pyridin-2-ylsulfonyl octanoate
Openeye Name:2-pyridylsulfonyl octanoate
CAS Name:octanoic acid 2-pyridinylsulfonyl ester
IUPAC Name:pyridin-2-ylsulfonyl octanoate
Traditional Name:caprylic acid 2-pyridylsulfonyl ester
Formula: C13H19NO4S
MolecularWeight: 285.35926
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OS(=O)(=O)C1=CC=CC=N1


Isomeric SMILES

CCCCCCCC(=O)OS(=O)(=O)C1=CC=CC=N1


InChI

InChI=1S/C13H19NO4S/c1-2-3-4-5-6-10-13(15)18-19(16,17)12-9-7-8-11-14-12/h7-9,11H,2-6,10H2,1H3


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