2-(3-chloranylpropyl)-5-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]-2-phenyl-pentanenitrile

Systemtic Name: 2-(3-chloranylpropyl)-5-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]-2-phenyl-pentanenitrile Openeye Name: 2-(3-chloropropyl)-5-[4-(4-fluorobenzoyl)-1-piperidyl]-2-phenyl-pentanenitrile CAS Name: 2-(3-chloropropyl)-5-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidinyl]-2-phenylpentanenitrile IUPAC Name: 2-(3-chloropropyl)-5-[4-(4-fluorobenzoyl)piperidin-1-yl]-2-phenylpentanenitrile Traditional Name: 2-(3-chloropropyl)-5-[4-(4-fluorobenzoyl)piperidino]-2-phenyl-valeronitrile Formula: C26H30ClFN2O MolecularWeight: 440.980603

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC=C(C=C2)F)CCCC(CCCCl)(C#N)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC=C(C=C2)F)CCCC(CCCCl)(C#N)C3=CC=CC=C3

InChI

InChI=1S/C26H30ClFN2O/c27-16-4-14-26(20-29,23-6-2-1-3-7-23)15-5-17-30-18-12-22(13-19-30)25(31)21-8-10-24(28)11-9-21/h1-3,6-11,22H,4-5,12-19H2