ditert-butyl (2S,3R)-3-methyl-5-oxidanylidene-4-phenylselanyl-pyrrolidine-1,2-dicarboxylate

Systemtic Name: ditert-butyl (2S,3R)-3-methyl-5-oxidanylidene-4-phenylselanyl-pyrrolidine-1,2-dicarboxylate Openeye Name: ditert-butyl (2S,3R)-3-methyl-5-oxo-4-phenylselanyl-pyrrolidine-1,2-dicarboxylate CAS Name: (2S,3R)-3-methyl-5-oxo-4-(phenylseleno)pyrrolidine-1,2-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl (2S,3R)-3-methyl-5-oxo-4-phenylselanylpyrrolidine-1,2-dicarboxylate Traditional Name: (2S,3R)-5-keto-3-methyl-4-(phenylseleno)pyrrolidine-1,2-dicarboxylic acid ditert-butyl ester Formula: C21H29NO5Se MolecularWeight: 454.41866

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)N(C1C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)[Se]C2=CC=CC=C2

Isomeric SMILES

C[C@@H]1[C@H](N(C(=O)C1[Se]C2=CC=CC=C2)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H29NO5Se/c1-13-15(18(24)26-20(2,3)4)22(19(25)27-21(5,6)7)17(23)16(13)28-14-11-9-8-10-12-14/h8-13,15-16H,1-7H3/t13-,15+,16?/m1/s1