methyl 2-(2-oxidanylidene-2-phenylmethoxy-1-sulfanyl-ethyl)benzoate

Systemtic Name: methyl 2-(2-oxidanylidene-2-phenylmethoxy-1-sulfanyl-ethyl)benzoate Openeye Name: methyl 2-(2-benzyloxy-2-oxo-1-sulfanyl-ethyl)benzoate CAS Name: 2-(1-mercapto-2-oxo-2-phenylmethoxyethyl)benzoic acid methyl ester IUPAC Name: methyl 2-(2-oxo-2-phenylmethoxy-1-sulfanylethyl)benzoate Traditional Name: 2-(2-benzoxy-2-keto-1-mercapto-ethyl)benzoic acid methyl ester Formula: C17H16O4S MolecularWeight: 316.37154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C(C(=O)OCC2=CC=CC=C2)S

Isomeric SMILES

COC(=O)C1=CC=CC=C1C(C(=O)OCC2=CC=CC=C2)S

InChI

InChI=1S/C17H16O4S/c1-20-16(18)14-10-6-5-9-13(14)15(22)17(19)21-11-12-7-3-2-4-8-12/h2-10,15,22H,11H2,1H3