dodecyl 2-phenyl-2-sulfanyl-ethanoate

Systemtic Name: dodecyl 2-phenyl-2-sulfanyl-ethanoate Openeye Name: dodecyl 2-phenyl-2-sulfanyl-acetate CAS Name: 2-mercapto-2-phenylacetic acid dodecyl ester IUPAC Name: dodecyl 2-phenyl-2-sulfanylacetate Traditional Name: 2-mercapto-2-phenyl-acetic acid lauryl ester Formula: C20H32O2S MolecularWeight: 336.53188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C(C1=CC=CC=C1)S

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C(C1=CC=CC=C1)S

InChI

InChI=1S/C20H32O2S/c1-2-3-4-5-6-7-8-9-10-14-17-22-20(21)19(23)18-15-12-11-13-16-18/h11-13,15-16,19,23H,2-10,14,17H2,1H3