1-adamantylmethyl 4-(dimethylsulfamoyl)benzoate

Systemtic Name: 1-adamantylmethyl 4-(dimethylsulfamoyl)benzoate Openeye Name: 1-adamantylmethyl 4-(dimethylsulfamoyl)benzoate CAS Name: 4-(dimethylsulfamoyl)benzoic acid 1-adamantylmethyl ester IUPAC Name: 1-adamantylmethyl 4-(dimethylsulfamoyl)benzoate Traditional Name: 4-(dimethylsulfamoyl)benzoic acid 1-adamantylmethyl ester Formula: C20H27NO4S MolecularWeight: 377.49768

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)OCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)OCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H27NO4S/c1-21(2)26(23,24)18-5-3-17(4-6-18)19(22)25-13-20-10-14-7-15(11-20)9-16(8-14)12-20/h3-6,14-16H,7-13H2,1-2H3