tert-butyl 3-(5-bromanylthiophen-2-yl)-6-chloranyl-3-oxidanyl-hexanoate

Systemtic Name: tert-butyl 3-(5-bromanylthiophen-2-yl)-6-chloranyl-3-oxidanyl-hexanoate Openeye Name: tert-butyl 3-(5-bromo-2-thienyl)-6-chloro-3-hydroxy-hexanoate CAS Name: 3-(5-bromo-2-thiophenyl)-6-chloro-3-hydroxyhexanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(5-bromothiophen-2-yl)-6-chloro-3-hydroxyhexanoate Traditional Name: 3-(5-bromo-2-thienyl)-6-chloro-3-hydroxy-hexanoic acid tert-butyl ester Formula: C14H20BrClO3S MolecularWeight: 383.7288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(CCCCl)(C1=CC=C(S1)Br)O

Isomeric SMILES

CC(C)(C)OC(=O)CC(CCCCl)(C1=CC=C(S1)Br)O

InChI

InChI=1S/C14H20BrClO3S/c1-13(2,3)19-12(17)9-14(18,7-4-8-16)10-5-6-11(15)20-10/h5-6,18H,4,7-9H2,1-3H3