13-(2-bromanylethynyl)-13-dodecyl-pentacosane

Systemtic Name: 13-(2-bromanylethynyl)-13-dodecyl-pentacosane Openeye Name: 13-(2-bromoethynyl)-13-dodecyl-pentacosane CAS Name: 13-(2-bromoethynyl)-13-dodecylpentacosane IUPAC Name: 13-(2-bromoethynyl)-13-dodecylpentacosane Traditional Name: 1-bromo-3,3-dilauryl-pentadec-1-yne Formula: C39H75Br MolecularWeight: 623.9168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCCCCCCCCCC)(CCCCCCCCCCCC)C#CBr

Isomeric SMILES

CCCCCCCCCCCCC(CCCCCCCCCCCC)(CCCCCCCCCCCC)C#CBr

InChI

InChI=1S/C39H75Br/c1-4-7-10-13-16-19-22-25-28-31-34-39(37-38-40,35-32-29-26-23-20-17-14-11-8-5-2)36-33-30-27-24-21-18-15-12-9-6-3/h4-36H2,1-3H3