tert-butyl (3S,4S)-3,4-bis[(4-nitrophenyl)sulfonylamino]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (3S,4S)-3,4-bis[(4-nitrophenyl)sulfonylamino]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (3S,4S)-3,4-bis[(4-nitrophenyl)sulfonylamino]pyrrolidine-1-carboxylate CAS Name: (3S,4S)-3,4-bis[(4-nitrophenyl)sulfonylamino]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3S,4S)-3,4-bis[(4-nitrophenyl)sulfonylamino]pyrrolidine-1-carboxylate Traditional Name: (3S,4S)-3,4-bis(nosylamino)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C21H25N5O10S2 MolecularWeight: 571.5807

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(C(C1)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@@H]([C@H](C1)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N5O10S2/c1-21(2,3)36-20(27)24-12-18(22-37(32,33)16-8-4-14(5-9-16)25(28)29)19(13-24)23-38(34,35)17-10-6-15(7-11-17)26(30)31/h4-11,18-19,22-23H,12-13H2,1-3H3/t18-,19-/m0/s1