tert-butyl (2R,3R,4S)-3-(4-bromophenyl)-4-diethoxyphosphoryl-2-methyl-5-oxidanylidene-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2R,3R,4S)-3-(4-bromophenyl)-4-diethoxyphosphoryl-2-methyl-5-oxidanylidene-pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2R,3R,4S)-3-(4-bromophenyl)-4-diethoxyphosphoryl-2-methyl-5-oxo-pyrrolidine-1-carboxylate CAS Name: (2R,3R,4S)-3-(4-bromophenyl)-4-diethoxyphosphoryl-2-methyl-5-oxo-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,3R,4S)-3-(4-bromophenyl)-4-diethoxyphosphoryl-2-methyl-5-oxopyrrolidine-1-carboxylate Traditional Name: (3S,4R,5R)-4-(4-bromophenyl)-3-diethoxyphosphoryl-2-keto-5-methyl-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C20H29BrNO6P MolecularWeight: 490.325121

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1C(C(N(C1=O)C(=O)OC(C)(C)C)C)C2=CC=C(C=C2)Br)OCC

Isomeric SMILES

CCOP(=O)([C@H]1[C@@H]([C@H](N(C1=O)C(=O)OC(C)(C)C)C)C2=CC=C(C=C2)Br)OCC

InChI

InChI=1S/C20H29BrNO6P/c1-7-26-29(25,27-8-2)17-16(14-9-11-15(21)12-10-14)13(3)22(18(17)23)19(24)28-20(4,5)6/h9-13,16-17H,7-8H2,1-6H3/t13-,16+,17+/m1/s1