2-[4-[(3R,4R)-3-[(4-bromophenyl)methoxy]piperidin-4-yl]phenoxy]-1-phenyl-ethanone

Systemtic Name: 2-[4-[(3R,4R)-3-[(4-bromophenyl)methoxy]piperidin-4-yl]phenoxy]-1-phenyl-ethanone Openeye Name: 2-[4-[(3R,4R)-3-[(4-bromophenyl)methoxy]-4-piperidyl]phenoxy]-1-phenyl-ethanone CAS Name: 2-[4-[(3R,4R)-3-[(4-bromophenyl)methoxy]-4-piperidinyl]phenoxy]-1-phenylethanone IUPAC Name: 2-[4-[(3R,4R)-3-[(4-bromophenyl)methoxy]piperidin-4-yl]phenoxy]-1-phenylethanone Traditional Name: 2-[4-[(3R,4R)-3-(4-bromobenzyl)oxy-4-piperidyl]phenoxy]-1-phenyl-ethanone Formula: C26H26BrNO3 MolecularWeight: 480.39354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(C1C2=CC=C(C=C2)OCC(=O)C3=CC=CC=C3)OCC4=CC=C(C=C4)Br

Isomeric SMILES

C1CNC[C@@H]([C@H]1C2=CC=C(C=C2)OCC(=O)C3=CC=CC=C3)OCC4=CC=C(C=C4)Br

InChI

InChI=1S/C26H26BrNO3/c27-22-10-6-19(7-11-22)17-31-26-16-28-15-14-24(26)20-8-12-23(13-9-20)30-18-25(29)21-4-2-1-3-5-21/h1-13,24,26,28H,14-18H2/t24-,26+/m1/s1