2-bromanyl-3-oxidanyl-3-thiophen-2-yl-undecan-5-one

Systemtic Name: 2-bromanyl-3-oxidanyl-3-thiophen-2-yl-undecan-5-one Openeye Name: 2-bromo-3-hydroxy-3-(2-thienyl)undecan-5-one CAS Name: 2-bromo-3-hydroxy-3-thiophen-2-yl-5-undecanone IUPAC Name: 2-bromo-3-hydroxy-3-thiophen-2-ylundecan-5-one Traditional Name: 2-bromo-3-hydroxy-3-(2-thienyl)undecan-5-one Formula: C15H23BrO2S MolecularWeight: 347.31092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)CC(C1=CC=CS1)(C(C)Br)O

Isomeric SMILES

CCCCCCC(=O)CC(C1=CC=CS1)(C(C)Br)O

InChI

InChI=1S/C15H23BrO2S/c1-3-4-5-6-8-13(17)11-15(18,12(2)16)14-9-7-10-19-14/h7,9-10,12,18H,3-6,8,11H2,1-2H3