2-(2-chloroethylsulfanyl)ethyl octadecanoate

Systemtic Name: 2-(2-chloroethylsulfanyl)ethyl octadecanoate Openeye Name: 2-(2-chloroethylsulfanyl)ethyl octadecanoate CAS Name: octadecanoic acid 2-(2-chloroethylthio)ethyl ester IUPAC Name: 2-(2-chloroethylsulfanyl)ethyl octadecanoate Traditional Name: stearic acid 2-(2-chloroethylthio)ethyl ester Formula: C22H43ClO2S MolecularWeight: 407.09362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCCSCCCl

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCCSCCCl

InChI

InChI=1S/C22H43ClO2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(24)25-19-21-26-20-18-23/h2-21H2,1H3