ethyl 2-fluoranyl-2-pyrimidin-2-ylsulfonyl-hept-6-enoate

Systemtic Name: ethyl 2-fluoranyl-2-pyrimidin-2-ylsulfonyl-hept-6-enoate Openeye Name: ethyl 2-fluoro-2-pyrimidin-2-ylsulfonyl-hept-6-enoate CAS Name: 2-fluoro-2-(2-pyrimidinylsulfonyl)-6-heptenoic acid ethyl ester IUPAC Name: ethyl 2-fluoro-2-pyrimidin-2-ylsulfonylhept-6-enoate Traditional Name: 2-fluoro-2-(2-pyrimidylsulfonyl)hept-6-enoic acid ethyl ester Formula: C13H17FN2O4S MolecularWeight: 316.348483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCC=C)(F)S(=O)(=O)C1=NC=CC=N1

Isomeric SMILES

CCOC(=O)C(CCCC=C)(F)S(=O)(=O)C1=NC=CC=N1

InChI

InChI=1S/C13H17FN2O4S/c1-3-5-6-8-13(14,11(17)20-4-2)21(18,19)12-15-9-7-10-16-12/h3,7,9-10H,1,4-6,8H2,2H3