2-[4-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-1-cyano-butyl]benzenecarbonitrile

Systemtic Name: 2-[4-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-1-cyano-butyl]benzenecarbonitrile Openeye Name: 2-[4-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-1-cyano-butyl]benzonitrile CAS Name: 2-[4-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-1-cyanobutyl]benzonitrile IUPAC Name: 2-[4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-1-cyanobutyl]benzonitrile Traditional Name: 2-[4-[4-(4-chlorophenyl)-4-hydroxy-piperidino]-1-cyano-butyl]benzonitrile Formula: C23H24ClN3O MolecularWeight: 393.90916

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CCCC(C#N)C3=CC=CC=C3C#N

Isomeric SMILES

C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CCCC(C#N)C3=CC=CC=C3C#N

InChI

InChI=1S/C23H24ClN3O/c24-21-9-7-20(8-10-21)23(28)11-14-27(15-12-23)13-3-5-19(17-26)22-6-2-1-4-18(22)16-25/h1-2,4,6-10,19,28H,3,5,11-15H2