(2-methoxy-2-oxidanylidene-ethyl) 2-(2-cyanophenyl)sulfanylbenzoate

Systemtic Name: (2-methoxy-2-oxidanylidene-ethyl) 2-(2-cyanophenyl)sulfanylbenzoate Openeye Name: (2-methoxy-2-oxo-ethyl) 2-(2-cyanophenyl)sulfanylbenzoate CAS Name: 2-[(2-cyanophenyl)thio]benzoic acid (2-methoxy-2-oxoethyl) ester IUPAC Name: (2-methoxy-2-oxoethyl) 2-(2-cyanophenyl)sulfanylbenzoate Traditional Name: 2-[(2-cyanophenyl)thio]benzoic acid (2-keto-2-methoxy-ethyl) ester Formula: C17H13NO4S MolecularWeight: 327.35442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC(=O)C1=CC=CC=C1SC2=CC=CC=C2C#N

Isomeric SMILES

COC(=O)COC(=O)C1=CC=CC=C1SC2=CC=CC=C2C#N

InChI

InChI=1S/C17H13NO4S/c1-21-16(19)11-22-17(20)13-7-3-5-9-15(13)23-14-8-4-2-6-12(14)10-18/h2-9H,11H2,1H3