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

Systemtic Name: 5-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-2-(1-methylpyrrol-2-yl)pentanenitrile Openeye Name: 5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-2-(1-methylpyrrol-2-yl)pentanenitrile CAS Name: 5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-2-(1-methyl-2-pyrrolyl)pentanenitrile IUPAC Name: 5-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-(1-methylpyrrol-2-yl)pentanenitrile Traditional Name: 5-[4-(4-chlorophenyl)-4-hydroxy-piperidino]-2-(1-methylpyrrol-2-yl)valeronitrile Formula: C21H26ClN3O MolecularWeight: 371.90364

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(CCCN2CCC(CC2)(C3=CC=C(C=C3)Cl)O)C#N

Isomeric SMILES

CN1C=CC=C1C(CCCN2CCC(CC2)(C3=CC=C(C=C3)Cl)O)C#N

InChI

InChI=1S/C21H26ClN3O/c1-24-12-3-5-20(24)17(16-23)4-2-13-25-14-10-21(26,11-15-25)18-6-8-19(22)9-7-18/h3,5-9,12,17,26H,2,4,10-11,13-15H2,1H3