[(3S,4S,5S)-4-ethanoyl-5-ethyl-2,3-diphenyl-1,2-oxazolidin-4-yl] 4-bromanylbenzoate

Systemtic Name: [(3S,4S,5S)-4-ethanoyl-5-ethyl-2,3-diphenyl-1,2-oxazolidin-4-yl] 4-bromanylbenzoate Openeye Name: [(3S,4S,5S)-4-acetyl-5-ethyl-2,3-diphenyl-isoxazolidin-4-yl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [(3S,4S,5S)-4-acetyl-5-ethyl-2,3-diphenyl-4-isoxazolidinyl] ester IUPAC Name: [(3S,4S,5S)-4-acetyl-5-ethyl-2,3-diphenyl-1,2-oxazolidin-4-yl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [(3S,4S,5S)-4-acetyl-5-ethyl-2,3-diphenyl-isoxazolidin-4-yl] ester Formula: C26H24BrNO4 MolecularWeight: 494.37706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C(N(O1)C2=CC=CC=C2)C3=CC=CC=C3)(C(=O)C)OC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC[C@H]1[C@@]([C@@H](N(O1)C2=CC=CC=C2)C3=CC=CC=C3)(C(=O)C)OC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C26H24BrNO4/c1-3-23-26(18(2)29,31-25(30)20-14-16-21(27)17-15-20)24(19-10-6-4-7-11-19)28(32-23)22-12-8-5-9-13-22/h4-17,23-24H,3H2,1-2H3/t23-,24-,26+/m0/s1