O1-ethyl O9-methyl 2-(4-acetyloxynonyl)-2-methylsulfonyl-non-4-ynedioate

Systemtic Name: O1-ethyl O9-methyl 2-(4-acetyloxynonyl)-2-methylsulfonyl-non-4-ynedioate Openeye Name: O1-ethyl O9-methyl 2-(4-acetoxynonyl)-2-methylsulfonyl-non-4-ynedioate CAS Name: 2-(4-acetyloxynonyl)-2-methylsulfonyl-4-nonynedioic acid O1-ethyl ester O9-methyl ester IUPAC Name: 1-O-ethyl 9-O-methyl 2-(4-acetyloxynonyl)-2-methylsulfonylnon-4-ynedioate Traditional Name: 2-(4-acetoxynonyl)-2-mesyl-non-4-ynedioic acid O1-ethyl ester O9-methyl ester Formula: C24H40O8S MolecularWeight: 488.6346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCC(CC#CCCCC(=O)OC)(C(=O)OCC)S(=O)(=O)C)OC(=O)C

Isomeric SMILES

CCCCCC(CCCC(CC#CCCCC(=O)OC)(C(=O)OCC)S(=O)(=O)C)OC(=O)C

InChI

InChI=1S/C24H40O8S/c1-6-8-11-15-21(32-20(3)25)16-14-19-24(33(5,28)29,23(27)31-7-2)18-13-10-9-12-17-22(26)30-4/h21H,6-9,11-12,14-19H2,1-5H3