2-(3,4-dimethoxyphenyl)-5-[4-(4-fluoranyl-2-oxidanyl-phenyl)carbonylpiperidin-1-yl]-2-propan-2-yl-pentanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-5-[4-(4-fluoranyl-2-oxidanyl-phenyl)carbonylpiperidin-1-yl]-2-propan-2-yl-pentanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-5-[4-(4-fluoro-2-hydroxy-benzoyl)-1-piperidyl]-2-isopropyl-pentanenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-5-[4-[(4-fluoro-2-hydroxyphenyl)-oxomethyl]-1-piperidinyl]-2-propan-2-ylpentanenitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-5-[4-(4-fluoro-2-hydroxybenzoyl)piperidin-1-yl]-2-propan-2-ylpentanenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-5-[4-(4-fluoro-2-hydroxy-benzoyl)piperidino]-2-isopropyl-valeronitrile Formula: C28H35FN2O4 MolecularWeight: 482.586903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCC(CC1)C(=O)C2=C(C=C(C=C2)F)O)(C#N)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)C(CCCN1CCC(CC1)C(=O)C2=C(C=C(C=C2)F)O)(C#N)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C28H35FN2O4/c1-19(2)28(18-30,21-6-9-25(34-3)26(16-21)35-4)12-5-13-31-14-10-20(11-15-31)27(33)23-8-7-22(29)17-24(23)32/h6-9,16-17,19-20,32H,5,10-15H2,1-4H3