propan-2-yl 3-chloranyl-2-(phenylmethylsulfanyl)benzoate

Systemtic Name: propan-2-yl 3-chloranyl-2-(phenylmethylsulfanyl)benzoate Openeye Name: isopropyl 2-benzylsulfanyl-3-chloro-benzoate CAS Name: 3-chloro-2-(phenylmethylthio)benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-benzylsulfanyl-3-chlorobenzoate Traditional Name: 2-(benzylthio)-3-chloro-benzoic acid isopropyl ester Formula: C17H17ClO2S MolecularWeight: 320.83368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(C(=CC=C1)Cl)SCC2=CC=CC=C2

Isomeric SMILES

CC(C)OC(=O)C1=C(C(=CC=C1)Cl)SCC2=CC=CC=C2

InChI

InChI=1S/C17H17ClO2S/c1-12(2)20-17(19)14-9-6-10-15(18)16(14)21-11-13-7-4-3-5-8-13/h3-10,12H,11H2,1-2H3