phenyl 3-methylsulfinyl-4-phenylmethoxy-benzoate

Systemtic Name: phenyl 3-methylsulfinyl-4-phenylmethoxy-benzoate Openeye Name: phenyl 4-benzyloxy-3-methylsulfinyl-benzoate CAS Name: 3-methylsulfinyl-4-phenylmethoxybenzoic acid phenyl ester IUPAC Name: phenyl 3-methylsulfinyl-4-phenylmethoxybenzoate Traditional Name: 4-benzoxy-3-methylsulfinyl-benzoic acid phenyl ester Formula: C21H18O4S MolecularWeight: 366.43022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=C(C=CC(=C1)C(=O)OC2=CC=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

CS(=O)C1=C(C=CC(=C1)C(=O)OC2=CC=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C21H18O4S/c1-26(23)20-14-17(21(22)25-18-10-6-3-7-11-18)12-13-19(20)24-15-16-8-4-2-5-9-16/h2-14H,15H2,1H3