S-(6-oxidanylhexyl) benzenecarbothioate

Systemtic Name: S-(6-oxidanylhexyl) benzenecarbothioate Openeye Name: S-(6-hydroxyhexyl) benzenecarbothioate CAS Name: benzenecarbothioic acid S-(6-hydroxyhexyl) ester IUPAC Name: S-(6-hydroxyhexyl) benzenecarbothioate Traditional Name: thiobenzoic acid S-(6-hydroxyhexyl) ester Formula: C13H18O2S MolecularWeight: 238.34582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SCCCCCCO

Isomeric SMILES

C1=CC=C(C=C1)C(=O)SCCCCCCO

InChI

InChI=1S/C13H18O2S/c14-10-6-1-2-7-11-16-13(15)12-8-4-3-5-9-12/h3-5,8-9,14H,1-2,6-7,10-11H2