methyl 2-hexylsulfanyl-2-phenyl-ethanoate

Systemtic Name: methyl 2-hexylsulfanyl-2-phenyl-ethanoate Openeye Name: methyl 2-hexylsulfanyl-2-phenyl-acetate CAS Name: 2-(hexylthio)-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-hexylsulfanyl-2-phenylacetate Traditional Name: 2-(hexylthio)-2-phenyl-acetic acid methyl ester Formula: C15H22O2S MolecularWeight: 266.39898

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC(C1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CCCCCCSC(C1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C15H22O2S/c1-3-4-5-9-12-18-14(15(16)17-2)13-10-7-6-8-11-13/h6-8,10-11,14H,3-5,9,12H2,1-2H3