2-methylundecan-2-yl 3-sulfanylpropanoate

Systemtic Name: 2-methylundecan-2-yl 3-sulfanylpropanoate Openeye Name: 1,1-dimethyldecyl 3-sulfanylpropanoate CAS Name: 3-mercaptopropanoic acid 2-methylundecan-2-yl ester IUPAC Name: 2-methylundecan-2-yl 3-sulfanylpropanoate Traditional Name: 3-mercaptopropionic acid 1,1-dimethyldecyl ester Formula: C15H30O2S MolecularWeight: 274.4625

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C)(C)OC(=O)CCS

Isomeric SMILES

CCCCCCCCCC(C)(C)OC(=O)CCS

InChI

InChI=1S/C15H30O2S/c1-4-5-6-7-8-9-10-12-15(2,3)17-14(16)11-13-18/h18H,4-13H2,1-3H3