S-[3-(4-methylphenoxy)-2-oxidanyl-propyl] benzenecarbothioate

Systemtic Name: S-[3-(4-methylphenoxy)-2-oxidanyl-propyl] benzenecarbothioate Openeye Name: S-[2-hydroxy-3-(4-methylphenoxy)propyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[2-hydroxy-3-(4-methylphenoxy)propyl] ester IUPAC Name: S-[2-hydroxy-3-(4-methylphenoxy)propyl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[2-hydroxy-3-(4-methylphenoxy)propyl] ester Formula: C17H18O3S MolecularWeight: 302.38802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC(CSC(=O)C2=CC=CC=C2)O

Isomeric SMILES

CC1=CC=C(C=C1)OCC(CSC(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C17H18O3S/c1-13-7-9-16(10-8-13)20-11-15(18)12-21-17(19)14-5-3-2-4-6-14/h2-10,15,18H,11-12H2,1H3