[(2S,3R,4R)-2-acetamido-3-acetyloxy-4-phenylselanyl-octadecyl] ethanoate

Systemtic Name: [(2S,3R,4R)-2-acetamido-3-acetyloxy-4-phenylselanyl-octadecyl] ethanoate Openeye Name: [(2S,3R,4R)-2-acetamido-3-acetoxy-4-phenylselanyl-octadecyl] acetate CAS Name: acetic acid [(2S,3R,4R)-2-acetamido-3-acetyloxy-4-(phenylseleno)octadecyl] ester IUPAC Name: [(2S,3R,4R)-2-acetamido-3-acetyloxy-4-phenylselanyloctadecyl] acetate Traditional Name: acetic acid [(2S,3R,4R)-2-acetamido-3-acetoxy-4-(phenylseleno)octadecyl] ester Formula: C30H49NO5Se MolecularWeight: 582.67376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C(C(COC(=O)C)NC(=O)C)OC(=O)C)[Se]C1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCC[C@H]([C@@H]([C@H](COC(=O)C)NC(=O)C)OC(=O)C)[Se]C1=CC=CC=C1

InChI

InChI=1S/C30H49NO5Se/c1-5-6-7-8-9-10-11-12-13-14-15-19-22-29(37-27-20-17-16-18-21-27)30(36-26(4)34)28(31-24(2)32)23-35-25(3)33/h16-18,20-21,28-30H,5-15,19,22-23H2,1-4H3,(H,31,32)/t28-,29+,30+/m0/s1