[(E)-16-bromanyl-2-oxidanyl-hexadec-15-en-3,5-diynyl] hydrogen sulfate

Systemtic Name: [(E)-16-bromanyl-2-oxidanyl-hexadec-15-en-3,5-diynyl] hydrogen sulfate Openeye Name: [(E)-16-bromo-2-hydroxy-hexadec-15-en-3,5-diynyl] hydrogen sulfate CAS Name: sulfuric acid [(E)-16-bromo-2-hydroxyhexadec-15-en-3,5-diynyl] ester IUPAC Name: [(E)-16-bromo-2-hydroxyhexadec-15-en-3,5-diynyl] hydrogen sulfate Traditional Name: sulfuric acid [(E)-16-bromo-2-hydroxy-hexadec-15-en-3,5-diynyl] ester Formula: C16H23BrO5S MolecularWeight: 407.31982

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCCC#CC#CC(COS(=O)(=O)O)O)CCCC=CBr

Isomeric SMILES

C(CCCCC#CC#CC(COS(=O)(=O)O)O)CCC/C=C/Br

InChI

InChI=1S/C16H23BrO5S/c17-14-12-10-8-6-4-2-1-3-5-7-9-11-13-16(18)15-22-23(19,20)21/h12,14,16,18H,1-6,8,10,15H2,(H,19,20,21)/b14-12+