tert-butyl 2-(tert-butylcarbamoyl)-4-(4-methylphenyl)sulfonyloxy-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-(tert-butylcarbamoyl)-4-(4-methylphenyl)sulfonyloxy-pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-(tert-butylcarbamoyl)-4-(p-tolylsulfonyloxy)pyrrolidine-1-carboxylate CAS Name: 2-[(tert-butylamino)-oxomethyl]-4-(4-methylphenyl)sulfonyloxy-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(tert-butylcarbamoyl)-4-(4-methylphenyl)sulfonyloxypyrrolidine-1-carboxylate Traditional Name: 2-(tert-butylcarbamoyl)-4-tosyloxy-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C21H32N2O6S MolecularWeight: 440.55358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(N(C2)C(=O)OC(C)(C)C)C(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(N(C2)C(=O)OC(C)(C)C)C(=O)NC(C)(C)C

InChI

InChI=1S/C21H32N2O6S/c1-14-8-10-16(11-9-14)30(26,27)29-15-12-17(18(24)22-20(2,3)4)23(13-15)19(25)28-21(5,6)7/h8-11,15,17H,12-13H2,1-7H3,(H,22,24)