S-(1-chloranyl-3-phenoxy-propan-2-yl) benzenecarbothioate

Systemtic Name: S-(1-chloranyl-3-phenoxy-propan-2-yl) benzenecarbothioate Openeye Name: S-[1-(chloromethyl)-2-phenoxy-ethyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-(1-chloro-3-phenoxypropan-2-yl) ester IUPAC Name: S-(1-chloro-3-phenoxypropan-2-yl) benzenecarbothioate Traditional Name: thiobenzoic acid S-[1-(chloromethyl)-2-phenoxy-ethyl] ester Formula: C16H15ClO2S MolecularWeight: 306.8071

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SC(COC2=CC=CC=C2)CCl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)SC(COC2=CC=CC=C2)CCl

InChI

InChI=1S/C16H15ClO2S/c17-11-15(12-19-14-9-5-2-6-10-14)20-16(18)13-7-3-1-4-8-13/h1-10,15H,11-12H2