5-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-2-(2-hydroxyphenyl)pentanenitrile

Systemtic Name: 5-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-2-(2-hydroxyphenyl)pentanenitrile Openeye Name: 5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-2-(2-hydroxyphenyl)pentanenitrile CAS Name: 5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-2-(2-hydroxyphenyl)pentanenitrile IUPAC Name: 5-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-(2-hydroxyphenyl)pentanenitrile Traditional Name: 5-[4-(4-chlorophenyl)-4-hydroxy-piperidino]-2-(2-hydroxyphenyl)valeronitrile Formula: C22H25ClN2O2 MolecularWeight: 384.8991

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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=C3O

Isomeric SMILES

C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CCCC(C#N)C3=CC=CC=C3O

InChI

InChI=1S/C22H25ClN2O2/c23-19-9-7-18(8-10-19)22(27)11-14-25(15-12-22)13-3-4-17(16-24)20-5-1-2-6-21(20)26/h1-2,5-10,17,26-27H,3-4,11-15H2