ethyl 2-fluoranyl-2-pyrimidin-2-ylsulfonyl-octanoate

Systemtic Name: ethyl 2-fluoranyl-2-pyrimidin-2-ylsulfonyl-octanoate Openeye Name: ethyl 2-fluoro-2-pyrimidin-2-ylsulfonyl-octanoate CAS Name: 2-fluoro-2-(2-pyrimidinylsulfonyl)octanoic acid ethyl ester IUPAC Name: ethyl 2-fluoro-2-pyrimidin-2-ylsulfonyloctanoate Traditional Name: 2-fluoro-2-(2-pyrimidylsulfonyl)caprylic acid ethyl ester Formula: C14H21FN2O4S MolecularWeight: 332.390943

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)OCC)(F)S(=O)(=O)C1=NC=CC=N1

Isomeric SMILES

CCCCCCC(C(=O)OCC)(F)S(=O)(=O)C1=NC=CC=N1

InChI

InChI=1S/C14H21FN2O4S/c1-3-5-6-7-9-14(15,12(18)21-4-2)22(19,20)13-16-10-8-11-17-13/h8,10-11H,3-7,9H2,1-2H3