S-phenyl 6-bromanylhexanethioate

Systemtic Name: S-phenyl 6-bromanylhexanethioate Openeye Name: S-phenyl 6-bromohexanethioate CAS Name: 6-bromohexanethioic acid S-phenyl ester IUPAC Name: S-phenyl 6-bromohexanethioate Traditional Name: 6-bromohexanethioic acid S-phenyl ester Formula: C12H15BrOS MolecularWeight: 287.2159

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC(=O)CCCCCBr

Isomeric SMILES

C1=CC=C(C=C1)SC(=O)CCCCCBr

InChI

InChI=1S/C12H15BrOS/c13-10-6-2-5-9-12(14)15-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2