methyl 2-deuterio-4-dodecylsulfanyl-2-methyl-4-oxidanylidene-butanoate

Systemtic Name: methyl 2-deuterio-4-dodecylsulfanyl-2-methyl-4-oxidanylidene-butanoate Openeye Name: methyl 2-deuterio-4-dodecylsulfanyl-2-methyl-4-oxo-butanoate CAS Name: 2-deuterio-4-(dodecylthio)-2-methyl-4-oxobutanoic acid methyl ester IUPAC Name: methyl 2-deuterio-4-dodecylsulfanyl-2-methyl-4-oxobutanoate Traditional Name: 2-deuterio-4-keto-4-(laurylthio)-2-methyl-butyric acid methyl ester Formula: C18H34O3S MolecularWeight: 331.531922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(=O)CC(C)C(=O)OC

Isomeric SMILES

[2H]C(C)(CC(=O)SCCCCCCCCCCCC)C(=O)OC

InChI

InChI=1S/C18H34O3S/c1-4-5-6-7-8-9-10-11-12-13-14-22-17(19)15-16(2)18(20)21-3/h16H,4-15H2,1-3H3/i16D