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(phenylmethyl) 5-sulfanylpentanoate

(phenylmethyl) 5-sulfanylpentanoate

Systemtic Name:(phenylmethyl) 5-sulfanylpentanoate
Openeye Name:benzyl 5-sulfanylpentanoate
CAS Name:5-mercaptopentanoic acid (phenylmethyl) ester
IUPAC Name:benzyl 5-sulfanylpentanoate
Traditional Name:5-mercaptovaleric acid benzyl ester
Formula: C12H16O2S
MolecularWeight: 224.31924
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCCCS


Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCCCS


InChI

InChI=1S/C12H16O2S/c13-12(8-4-5-9-15)14-10-11-6-2-1-3-7-11/h1-3,6-7,15H,4-5,8-10H2


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