methyl 4-[2-cyano-2-(phenylsulfonyl)ethenyl]benzoate

Systemtic Name: methyl 4-[2-cyano-2-(phenylsulfonyl)ethenyl]benzoate Openeye Name: methyl 4-[2-(benzenesulfonyl)-2-cyano-vinyl]benzoate CAS Name: 4-[2-(benzenesulfonyl)-2-cyanoethenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(benzenesulfonyl)-2-cyanoethenyl]benzoate Traditional Name: 4-(2-besyl-2-cyano-vinyl)benzoic acid methyl ester Formula: C17H13NO4S MolecularWeight: 327.35442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C(C#N)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C=C(C#N)S(=O)(=O)C2=CC=CC=C2

InChI

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