methyl 1-[[2-chloranyl-5-(dimethylsulfamoyl)phenyl]carbonylamino]cycloheptane-1-carboxylate

Systemtic Name: methyl 1-[[2-chloranyl-5-(dimethylsulfamoyl)phenyl]carbonylamino]cycloheptane-1-carboxylate Openeye Name: methyl 1-[[2-chloro-5-(dimethylsulfamoyl)benzoyl]amino]cycloheptanecarboxylate CAS Name: 1-[[[2-chloro-5-(dimethylsulfamoyl)phenyl]-oxomethyl]amino]-1-cycloheptanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[2-chloro-5-(dimethylsulfamoyl)benzoyl]amino]cycloheptane-1-carboxylate Traditional Name: 1-[[2-chloro-5-(dimethylsulfamoyl)benzoyl]amino]cycloheptanecarboxylic acid methyl ester Formula: C18H25ClN2O5S MolecularWeight: 416.9195

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)NC2(CCCCCC2)C(=O)OC

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)NC2(CCCCCC2)C(=O)OC

InChI

InChI=1S/C18H25ClN2O5S/c1-21(2)27(24,25)13-8-9-15(19)14(12-13)16(22)20-18(17(23)26-3)10-6-4-5-7-11-18/h8-9,12H,4-7,10-11H2,1-3H3,(H,20,22)