1-[2-[[2-chloranyl-5-(diethylsulfamoyl)phenyl]amino]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[2-[[2-chloranyl-5-(diethylsulfamoyl)phenyl]amino]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-[2-chloro-5-(diethylsulfamoyl)anilino]-2-oxo-ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-[2-chloro-5-(diethylsulfamoyl)anilino]-2-oxoethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-[2-chloro-5-(diethylsulfamoyl)anilino]-2-oxoethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-[2-chloro-5-(diethylsulfamoyl)anilino]-2-keto-ethyl]cycloheptanecarboxylic acid Formula: C20H29ClN2O5S MolecularWeight: 444.97266

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=O)CC2(CCCCCC2)C(=O)O

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=O)CC2(CCCCCC2)C(=O)O

InChI

InChI=1S/C20H29ClN2O5S/c1-3-23(4-2)29(27,28)15-9-10-16(21)17(13-15)22-18(24)14-20(19(25)26)11-7-5-6-8-12-20/h9-10,13H,3-8,11-12,14H2,1-2H3,(H,22,24)(H,25,26)