(4-chlorophenyl)methyl 2-sulfanylbenzenesulfonate

Systemtic Name: (4-chlorophenyl)methyl 2-sulfanylbenzenesulfonate Openeye Name: (4-chlorophenyl)methyl 2-sulfanylbenzenesulfonate CAS Name: 2-mercaptobenzenesulfonic acid (4-chlorophenyl)methyl ester IUPAC Name: (4-chlorophenyl)methyl 2-sulfanylbenzenesulfonate Traditional Name: 2-mercaptobenzenesulfonic acid (4-chlorobenzyl) ester Formula: C13H11ClO3S2 MolecularWeight: 314.80764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)S)S(=O)(=O)OCC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC=C(C(=C1)S)S(=O)(=O)OCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H11ClO3S2/c14-11-7-5-10(6-8-11)9-17-19(15,16)13-4-2-1-3-12(13)18/h1-8,18H,9H2