[3-(dimethylsulfamoyl)phenyl]methyl 1-(1-adamantylcarbonyl)pyrrolidine-2-carboxylate

Systemtic Name: [3-(dimethylsulfamoyl)phenyl]methyl 1-(1-adamantylcarbonyl)pyrrolidine-2-carboxylate Openeye Name: [3-(dimethylsulfamoyl)phenyl]methyl 1-(adamantane-1-carbonyl)pyrrolidine-2-carboxylate CAS Name: 1-[1-adamantyl(oxo)methyl]-2-pyrrolidinecarboxylic acid [3-(dimethylsulfamoyl)phenyl]methyl ester IUPAC Name: [3-(dimethylsulfamoyl)phenyl]methyl 1-(adamantane-1-carbonyl)pyrrolidine-2-carboxylate Traditional Name: 1-(adamantane-1-carbonyl)pyrrolidine-2-carboxylic acid [3-(dimethylsulfamoyl)benzyl] ester Formula: C25H34N2O5S MolecularWeight: 474.61286

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)COC(=O)C2CCCN2C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)COC(=O)C2CCCN2C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H34N2O5S/c1-26(2)33(30,31)21-6-3-5-17(12-21)16-32-23(28)22-7-4-8-27(22)24(29)25-13-18-9-19(14-25)11-20(10-18)15-25/h3,5-6,12,18-20,22H,4,7-11,13-16H2,1-2H3