5-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-2-(3-phenoxyphenyl)pentanenitrile

Systemtic Name: 5-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-2-(3-phenoxyphenyl)pentanenitrile Openeye Name: 5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-2-(3-phenoxyphenyl)pentanenitrile CAS Name: 5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-2-(3-phenoxyphenyl)pentanenitrile IUPAC Name: 5-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-(3-phenoxyphenyl)pentanenitrile Traditional Name: 5-[4-(4-chlorophenyl)-4-hydroxy-piperidino]-2-(3-phenoxyphenyl)valeronitrile Formula: C28H29ClN2O2 MolecularWeight: 460.99506

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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=C3)OC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CCCC(C#N)C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C28H29ClN2O2/c29-25-13-11-24(12-14-25)28(32)15-18-31(19-16-28)17-5-7-23(21-30)22-6-4-10-27(20-22)33-26-8-2-1-3-9-26/h1-4,6,8-14,20,23,32H,5,7,15-19H2