[1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 2-chloranyl-5-(diethylsulfamoyl)benzoate

Systemtic Name: [1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 2-chloranyl-5-(diethylsulfamoyl)benzoate Openeye Name: [2-(cyclohexylmethylamino)-1-methyl-2-oxo-ethyl] 2-chloro-5-(diethylsulfamoyl)benzoate CAS Name: 2-chloro-5-(diethylsulfamoyl)benzoic acid [1-(cyclohexylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclohexylmethylamino)-1-oxopropan-2-yl] 2-chloro-5-(diethylsulfamoyl)benzoate Traditional Name: 2-chloro-5-(diethylsulfamoyl)benzoic acid [2-(cyclohexylmethylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H31ClN2O5S MolecularWeight: 458.99924

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OC(C)C(=O)NCC2CCCCC2

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OC(C)C(=O)NCC2CCCCC2

InChI

InChI=1S/C21H31ClN2O5S/c1-4-24(5-2)30(27,28)17-11-12-19(22)18(13-17)21(26)29-15(3)20(25)23-14-16-9-7-6-8-10-16/h11-13,15-16H,4-10,14H2,1-3H3,(H,23,25)