[(3R,4R)-4-phenylpiperidin-3-yl] 4-iodanylbenzoate

Systemtic Name: [(3R,4R)-4-phenylpiperidin-3-yl] 4-iodanylbenzoate Openeye Name: [(3R,4R)-4-phenyl-3-piperidyl] 4-iodobenzoate CAS Name: 4-iodobenzoic acid [(3R,4R)-4-phenyl-3-piperidinyl] ester IUPAC Name: [(3R,4R)-4-phenylpiperidin-3-yl] 4-iodobenzoate Traditional Name: 4-iodobenzoic acid [(3R,4R)-4-phenyl-3-piperidyl] ester Formula: C18H18INO2 MolecularWeight: 407.24549

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(C1C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)I

Isomeric SMILES

C1CNC[C@@H]([C@H]1C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)I

InChI

InChI=1S/C18H18INO2/c19-15-8-6-14(7-9-15)18(21)22-17-12-20-11-10-16(17)13-4-2-1-3-5-13/h1-9,16-17,20H,10-12H2/t16-,17+/m1/s1