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

Systemtic Name: S-[3-(4-chloranylphenoxy)-2-oxidanyl-propyl] benzenecarbothioate Openeye Name: S-[3-(4-chlorophenoxy)-2-hydroxy-propyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[3-(4-chlorophenoxy)-2-hydroxypropyl] ester IUPAC Name: S-[3-(4-chlorophenoxy)-2-hydroxypropyl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[3-(4-chlorophenoxy)-2-hydroxy-propyl] ester Formula: C16H15ClO3S MolecularWeight: 322.8065

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SCC(COC2=CC=C(C=C2)Cl)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)SCC(COC2=CC=C(C=C2)Cl)O

InChI

InChI=1S/C16H15ClO3S/c17-13-6-8-15(9-7-13)20-10-14(18)11-21-16(19)12-4-2-1-3-5-12/h1-9,14,18H,10-11H2