undecyl 2-phenylsulfanylethanoate

Systemtic Name: undecyl 2-phenylsulfanylethanoate Openeye Name: undecyl 2-phenylsulfanylacetate CAS Name: 2-(phenylthio)acetic acid undecyl ester IUPAC Name: undecyl 2-phenylsulfanylacetate Traditional Name: 2-(phenylthio)acetic acid undecyl ester Formula: C19H30O2S MolecularWeight: 322.5053

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC(=O)CSC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCOC(=O)CSC1=CC=CC=C1

InChI

InChI=1S/C19H30O2S/c1-2-3-4-5-6-7-8-9-13-16-21-19(20)17-22-18-14-11-10-12-15-18/h10-12,14-15H,2-9,13,16-17H2,1H3