2-(1-adamantyl)ethyl 4-(dimethylsulfamoyl)benzoate

Systemtic Name: 2-(1-adamantyl)ethyl 4-(dimethylsulfamoyl)benzoate Openeye Name: 2-(1-adamantyl)ethyl 4-(dimethylsulfamoyl)benzoate CAS Name: 4-(dimethylsulfamoyl)benzoic acid 2-(1-adamantyl)ethyl ester IUPAC Name: 2-(1-adamantyl)ethyl 4-(dimethylsulfamoyl)benzoate Traditional Name: 4-(dimethylsulfamoyl)benzoic acid 2-(1-adamantyl)ethyl ester Formula: C21H29NO4S MolecularWeight: 391.52426

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)OCCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)OCCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H29NO4S/c1-22(2)27(24,25)19-5-3-18(4-6-19)20(23)26-8-7-21-12-15-9-16(13-21)11-17(10-15)14-21/h3-6,15-17H,7-14H2,1-2H3