1-[2-[[4-chloranyl-3-(dimethylsulfamoyl)phenyl]amino]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[2-[[4-chloranyl-3-(dimethylsulfamoyl)phenyl]amino]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-[4-chloro-3-(dimethylsulfamoyl)anilino]-2-oxo-ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-[4-chloro-3-(dimethylsulfamoyl)anilino]-2-oxoethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-[4-chloro-3-(dimethylsulfamoyl)anilino]-2-oxoethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-[4-chloro-3-(dimethylsulfamoyl)anilino]-2-keto-ethyl]cycloheptanecarboxylic acid Formula: C18H25ClN2O5S MolecularWeight: 416.9195

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25ClN2O5S/c1-21(2)27(25,26)15-11-13(7-8-14(15)19)20-16(22)12-18(17(23)24)9-5-3-4-6-10-18/h7-8,11H,3-6,9-10,12H2,1-2H3,(H,20,22)(H,23,24)