2-(5-bromanyl-1H-indol-3-yl)-1-[(2R,3R)-3-phenyl-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanone

Systemtic Name: 2-(5-bromanyl-1H-indol-3-yl)-1-[(2R,3R)-3-phenyl-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanone Openeye Name: 2-(5-bromo-1H-indol-3-yl)-1-[(2R,3R)-3-phenyl-2-(pyrrolidin-1-ylmethyl)-1-piperidyl]ethanone CAS Name: 2-(5-bromo-1H-indol-3-yl)-1-[(2R,3R)-3-phenyl-2-(1-pyrrolidinylmethyl)-1-piperidinyl]ethanone IUPAC Name: 2-(5-bromo-1H-indol-3-yl)-1-[(2R,3R)-3-phenyl-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanone Traditional Name: 2-(5-bromo-1H-indol-3-yl)-1-[(2R,3R)-3-phenyl-2-(pyrrolidinomethyl)piperidino]ethanone Formula: C26H30BrN3O MolecularWeight: 480.4399

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2C(CCCN2C(=O)CC3=CNC4=C3C=C(C=C4)Br)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C[C@H]2[C@H](CCCN2C(=O)CC3=CNC4=C3C=C(C=C4)Br)C5=CC=CC=C5

InChI

InChI=1S/C26H30BrN3O/c27-21-10-11-24-23(16-21)20(17-28-24)15-26(31)30-14-6-9-22(19-7-2-1-3-8-19)25(30)18-29-12-4-5-13-29/h1-3,7-8,10-11,16-17,22,25,28H,4-6,9,12-15,18H2/t22-,25+/m1/s1