[(6S,9Z)-13-(methoxymethoxy)-9,13-dimethyl-8-oxidanylidene-6-prop-1-en-2-yl-cyclotetradec-9-en-2,11-diyn-1-yl] methanesulfonate

Systemtic Name: [(6S,9Z)-13-(methoxymethoxy)-9,13-dimethyl-8-oxidanylidene-6-prop-1-en-2-yl-cyclotetradec-9-en-2,11-diyn-1-yl] methanesulfonate Openeye Name: [(6S,9Z)-6-isopropenyl-13-(methoxymethoxy)-9,13-dimethyl-8-oxo-cyclotetradec-9-en-2,11-diyn-1-yl] methanesulfonate CAS Name: methanesulfonic acid [(6S,9Z)-13-(methoxymethoxy)-9,13-dimethyl-6-(1-methylethenyl)-8-oxo-1-cyclotetradec-9-en-2,11-diynyl] ester IUPAC Name: [(6S,9Z)-13-(methoxymethoxy)-9,13-dimethyl-8-oxo-6-prop-1-en-2-ylcyclotetradec-9-en-2,11-diyn-1-yl] methanesulfonate Traditional Name: methanesulfonic acid [(6S,9Z)-6-isopropenyl-8-keto-13-(methoxymethoxy)-9,13-dimethyl-cyclotetradec-9-en-2,11-diyn-1-yl] ester Formula: C22H30O6S MolecularWeight: 422.535

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC#CC(CC(C#CCCC(CC1=O)C(=C)C)OS(=O)(=O)C)(C)OCOC

Isomeric SMILES

C/C/1=C/C#CC(CC(C#CCC[C@@H](CC1=O)C(=C)C)OS(=O)(=O)C)(C)OCOC

InChI

InChI=1S/C22H30O6S/c1-17(2)19-11-7-8-12-20(28-29(6,24)25)15-22(4,27-16-26-5)13-9-10-18(3)21(23)14-19/h10,19-20H,1,7,11,14-16H2,2-6H3/b18-10-/t19-,20?,22?/m0/s1