tert-butyl (2R)-2-[(2-chloranyl-5-methylsulfonyl-phenyl)carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2R)-2-[(2-chloranyl-5-methylsulfonyl-phenyl)carbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2R)-2-[(2-chloro-5-methylsulfonyl-phenyl)carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2R)-2-[(2-chloro-5-methylsulfonylanilino)-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-[(2-chloro-5-methylsulfonylphenyl)carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2R)-2-[(2-chloro-5-mesyl-phenyl)carbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C17H23ClN2O5S MolecularWeight: 402.89292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)NC2=C(C=CC(=C2)S(=O)(=O)C)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NC2=C(C=CC(=C2)S(=O)(=O)C)Cl

InChI

InChI=1S/C17H23ClN2O5S/c1-17(2,3)25-16(22)20-9-5-6-14(20)15(21)19-13-10-11(26(4,23)24)7-8-12(13)18/h7-8,10,14H,5-6,9H2,1-4H3,(H,19,21)/t14-/m1/s1