dimethyl 2-[(Z)-3-iodanylpentadec-2-en-6,10-diynyl]-2-(8-oxidanylocta-2,6-diynyl)propanedioate

Systemtic Name: dimethyl 2-[(Z)-3-iodanylpentadec-2-en-6,10-diynyl]-2-(8-oxidanylocta-2,6-diynyl)propanedioate Openeye Name: dimethyl 2-(8-hydroxyocta-2,6-diynyl)-2-[(Z)-3-iodopentadec-2-en-6,10-diynyl]propanedioate CAS Name: 2-(8-hydroxyocta-2,6-diynyl)-2-[(Z)-3-iodopentadec-2-en-6,10-diynyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(8-hydroxyocta-2,6-diynyl)-2-[(Z)-3-iodopentadec-2-en-6,10-diynyl]propanedioate Traditional Name: 2-(8-hydroxyocta-2,6-diynyl)-2-[(Z)-3-iodopentadec-2-en-6,10-diynyl]malonic acid dimethyl ester Formula: C28H35IO5 MolecularWeight: 578.47897

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CCCC#CCCC(=CCC(CC#CCCC#CCO)(C(=O)OC)C(=O)OC)I

Isomeric SMILES

CCCCC#CCCC#CCC/C(=C/CC(CC#CCCC#CCO)(C(=O)OC)C(=O)OC)/I

InChI

InChI=1S/C28H35IO5/c1-4-5-6-7-8-9-10-11-14-17-20-25(29)21-23-28(26(31)33-2,27(32)34-3)22-18-15-12-13-16-19-24-30/h21,30H,4-6,9-10,12-13,17,20,22-24H2,1-3H3/b25-21-