(4-bromophenyl)methyl 2-methoxy-4-methylsulfanyl-benzoate

Systemtic Name: (4-bromophenyl)methyl 2-methoxy-4-methylsulfanyl-benzoate Openeye Name: (4-bromophenyl)methyl 2-methoxy-4-methylsulfanyl-benzoate CAS Name: 2-methoxy-4-(methylthio)benzoic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 2-methoxy-4-methylsulfanylbenzoate Traditional Name: 2-methoxy-4-(methylthio)benzoic acid (4-bromobenzyl) ester Formula: C16H15BrO3S MolecularWeight: 367.2575

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C(=O)OCC2=CC=C(C=C2)Br

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C(=O)OCC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H15BrO3S/c1-19-15-9-13(21-2)7-8-14(15)16(18)20-10-11-3-5-12(17)6-4-11/h3-9H,10H2,1-2H3