3-chloranyl-4-[(2R)-4-[(2R)-2-oxidanyl-2-phenyl-ethanoyl]-2-phenyl-piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 3-chloranyl-4-[(2R)-4-[(2R)-2-oxidanyl-2-phenyl-ethanoyl]-2-phenyl-piperazin-1-yl]benzenecarbonitrile Openeye Name: 3-chloro-4-[(2R)-4-[(2R)-2-hydroxy-2-phenyl-acetyl]-2-phenyl-piperazin-1-yl]benzonitrile CAS Name: 3-chloro-4-[(2R)-4-[(2R)-2-hydroxy-1-oxo-2-phenylethyl]-2-phenyl-1-piperazinyl]benzonitrile IUPAC Name: 3-chloro-4-[(2R)-4-[(2R)-2-hydroxy-2-phenylacetyl]-2-phenylpiperazin-1-yl]benzonitrile Traditional Name: 3-chloro-4-[(2R)-4-[(2R)-2-hydroxy-2-phenyl-acetyl]-2-phenyl-piperazino]benzonitrile Formula: C25H22ClN3O2 MolecularWeight: 431.91408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1C(=O)C(C2=CC=CC=C2)O)C3=CC=CC=C3)C4=C(C=C(C=C4)C#N)Cl

Isomeric SMILES

C1CN([C@@H](CN1C(=O)[C@@H](C2=CC=CC=C2)O)C3=CC=CC=C3)C4=C(C=C(C=C4)C#N)Cl

InChI

InChI=1S/C25H22ClN3O2/c26-21-15-18(16-27)11-12-22(21)29-14-13-28(17-23(29)19-7-3-1-4-8-19)25(31)24(30)20-9-5-2-6-10-20/h1-12,15,23-24,30H,13-14,17H2/t23-,24+/m0/s1