methyl (E)-18-bromanylnonadec-17-en-5,7,15-triynoate

Systemtic Name: methyl (E)-18-bromanylnonadec-17-en-5,7,15-triynoate Openeye Name: methyl (E)-18-bromononadec-17-en-5,7,15-triynoate CAS Name: (E)-18-bromononadec-17-en-5,7,15-triynoic acid methyl ester IUPAC Name: methyl (E)-18-bromononadec-17-en-5,7,15-triynoate Traditional Name: (E)-18-bromononadec-17-en-5,7,15-triynoic acid methyl ester Formula: C20H25BrO2 MolecularWeight: 377.3153

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC#CCCCCCCC#CC#CCCCC(=O)OC)Br

Isomeric SMILES

C/C(=C\C#CCCCCCCC#CC#CCCCC(=O)OC)/Br

InChI

InChI=1S/C20H25BrO2/c1-19(21)17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20(22)23-2/h17H,3-5,7,9,11,14,16,18H2,1-2H3/b19-17+