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

Systemtic Name: 5-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-2-(4-ethoxyphenyl)pentanenitrile Openeye Name: 5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-2-(4-ethoxyphenyl)pentanenitrile CAS Name: 5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-2-(4-ethoxyphenyl)pentanenitrile IUPAC Name: 5-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-(4-ethoxyphenyl)pentanenitrile Traditional Name: 5-[4-(4-chlorophenyl)-4-hydroxy-piperidino]-2-p-phenetyl-valeronitrile Formula: C24H29ClN2O2 MolecularWeight: 412.95226

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(CCCN2CCC(CC2)(C3=CC=C(C=C3)Cl)O)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)C(CCCN2CCC(CC2)(C3=CC=C(C=C3)Cl)O)C#N

InChI

InChI=1S/C24H29ClN2O2/c1-2-29-23-11-5-19(6-12-23)20(18-26)4-3-15-27-16-13-24(28,14-17-27)21-7-9-22(25)10-8-21/h5-12,20,28H,2-4,13-17H2,1H3