tert-butyl (2S,3R,4S)-3-(4-bromophenyl)-4-nitro-5,5-diphenyl-pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl (2S,3R,4S)-3-(4-bromophenyl)-4-nitro-5,5-diphenyl-pyrrolidine-2-carboxylate Openeye Name: tert-butyl (2S,3R,4S)-3-(4-bromophenyl)-4-nitro-5,5-diphenyl-pyrrolidine-2-carboxylate CAS Name: (2S,3R,4S)-3-(4-bromophenyl)-4-nitro-5,5-diphenyl-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3R,4S)-3-(4-bromophenyl)-4-nitro-5,5-diphenylpyrrolidine-2-carboxylate Traditional Name: (2S,3R,4S)-3-(4-bromophenyl)-4-nitro-5,5-diphenyl-pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C27H27BrN2O4 MolecularWeight: 523.41828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1C(C(C(N1)(C2=CC=CC=C2)C3=CC=CC=C3)[N+](=O)[O-])C4=CC=C(C=C4)Br

Isomeric SMILES

CC(C)(C)OC(=O)[C@@H]1[C@H]([C@@H](C(N1)(C2=CC=CC=C2)C3=CC=CC=C3)[N+](=O)[O-])C4=CC=C(C=C4)Br

InChI

InChI=1S/C27H27BrN2O4/c1-26(2,3)34-25(31)23-22(18-14-16-21(28)17-15-18)24(30(32)33)27(29-23,19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-17,22-24,29H,1-3H3/t22-,23+,24+/m1/s1