methyl 4-[2-(3,3-dimethylbut-1-ynylsulfinyl)ethoxy]but-2-ynoate

Systemtic Name: methyl 4-[2-(3,3-dimethylbut-1-ynylsulfinyl)ethoxy]but-2-ynoate Openeye Name: methyl 4-[2-(3,3-dimethylbut-1-ynylsulfinyl)ethoxy]but-2-ynoate CAS Name: 4-[2-(3,3-dimethylbut-1-ynylsulfinyl)ethoxy]-2-butynoic acid methyl ester IUPAC Name: methyl 4-[2-(3,3-dimethylbut-1-ynylsulfinyl)ethoxy]but-2-ynoate Traditional Name: 4-[2-(3,3-dimethylbut-1-ynylsulfinyl)ethoxy]but-2-ynoic acid methyl ester Formula: C13H18O4S MolecularWeight: 270.34462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CS(=O)CCOCC#CC(=O)OC

Isomeric SMILES

CC(C)(C)C#CS(=O)CCOCC#CC(=O)OC

InChI

InChI=1S/C13H18O4S/c1-13(2,3)7-10-18(15)11-9-17-8-5-6-12(14)16-4/h8-9,11H2,1-4H3