[1-[[2-chloranyl-5-(diethylsulfamoyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 3,4-dimethylbenzoate

Systemtic Name: [1-[[2-chloranyl-5-(diethylsulfamoyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 3,4-dimethylbenzoate Openeye Name: [2-[2-chloro-5-(diethylsulfamoyl)anilino]-1-methyl-2-oxo-ethyl] 3,4-dimethylbenzoate CAS Name: 3,4-dimethylbenzoic acid [1-[2-chloro-5-(diethylsulfamoyl)anilino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[2-chloro-5-(diethylsulfamoyl)anilino]-1-oxopropan-2-yl] 3,4-dimethylbenzoate Traditional Name: 3,4-dimethylbenzoic acid [2-[2-chloro-5-(diethylsulfamoyl)anilino]-2-keto-1-methyl-ethyl] ester Formula: C22H27ClN2O5S MolecularWeight: 466.97818

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=O)C(C)OC(=O)C2=CC(=C(C=C2)C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=O)C(C)OC(=O)C2=CC(=C(C=C2)C)C

InChI

InChI=1S/C22H27ClN2O5S/c1-6-25(7-2)31(28,29)18-10-11-19(23)20(13-18)24-21(26)16(5)30-22(27)17-9-8-14(3)15(4)12-17/h8-13,16H,6-7H2,1-5H3,(H,24,26)