[2-[(3,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl] 3-methylsulfonylbenzoate

Systemtic Name: [2-[(3,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl] 3-methylsulfonylbenzoate Openeye Name: [2-(3,4-dichloroanilino)-2-oxo-ethyl] 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid [2-(3,4-dichloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dichloroanilino)-2-oxoethyl] 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid [2-(3,4-dichloroanilino)-2-keto-ethyl] ester Formula: C16H13Cl2NO5S MolecularWeight: 402.24912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC(=O)NC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC(=O)NC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H13Cl2NO5S/c1-25(22,23)12-4-2-3-10(7-12)16(21)24-9-15(20)19-11-5-6-13(17)14(18)8-11/h2-8H,9H2,1H3,(H,19,20)