(9E,17E)-18-bromanyloctadeca-9,17-dien-5,7-diynoic acid

Systemtic Name: (9E,17E)-18-bromanyloctadeca-9,17-dien-5,7-diynoic acid Openeye Name: (9E,17E)-18-bromooctadeca-9,17-dien-5,7-diynoic acid CAS Name: (9E,17E)-18-bromooctadeca-9,17-dien-5,7-diynoic acid IUPAC Name: (9E,17E)-18-bromooctadeca-9,17-dien-5,7-diynoic acid Traditional Name: (9E,17E)-18-bromooctadeca-9,17-dien-5,7-diynoic acid Formula: C18H23BrO2 MolecularWeight: 351.27802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23BrO2/c19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18(20)21/h1-2,15,17H,3,5,7,9,11-14,16H2,(H,20,21)/b2-1+,17-15+