[2-(2,4-dimethoxyphenyl)-2-oxidanylidene-ethyl] 2-methylsulfonylbenzoate

Systemtic Name: [2-(2,4-dimethoxyphenyl)-2-oxidanylidene-ethyl] 2-methylsulfonylbenzoate Openeye Name: [2-(2,4-dimethoxyphenyl)-2-oxo-ethyl] 2-methylsulfonylbenzoate CAS Name: 2-methylsulfonylbenzoic acid [2-(2,4-dimethoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dimethoxyphenyl)-2-oxoethyl] 2-methylsulfonylbenzoate Traditional Name: 2-mesylbenzoic acid [2-(2,4-dimethoxyphenyl)-2-keto-ethyl] ester Formula: C18H18O7S MolecularWeight: 378.39632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2S(=O)(=O)C)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2S(=O)(=O)C)OC

InChI

InChI=1S/C18H18O7S/c1-23-12-8-9-13(16(10-12)24-2)15(19)11-25-18(20)14-6-4-5-7-17(14)26(3,21)22/h4-10H,11H2,1-3H3