2-(3,4-dimethoxyphenyl)-5-(4-fluorophenyl)-5-oxidanyl-4-piperidin-1-yl-pentanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-5-(4-fluorophenyl)-5-oxidanyl-4-piperidin-1-yl-pentanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-5-(4-fluorophenyl)-5-hydroxy-4-(1-piperidyl)pentanenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-5-(4-fluorophenyl)-5-hydroxy-4-(1-piperidinyl)pentanenitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-5-(4-fluorophenyl)-5-hydroxy-4-piperidin-1-ylpentanenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-5-(4-fluorophenyl)-5-hydroxy-4-piperidino-valeronitrile Formula: C24H29FN2O3 MolecularWeight: 412.497063

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC(C(C2=CC=C(C=C2)F)O)N3CCCCC3)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC(C(C2=CC=C(C=C2)F)O)N3CCCCC3)C#N)OC

InChI

InChI=1S/C24H29FN2O3/c1-29-22-11-8-18(15-23(22)30-2)19(16-26)14-21(27-12-4-3-5-13-27)24(28)17-6-9-20(25)10-7-17/h6-11,15,19,21,24,28H,3-5,12-14H2,1-2H3