3-[[3-(4-fluoranyl-2-methyl-phenyl)-1-(2-pyrrolidin-1-ylethanoyl)piperidin-4-yl]oxymethyl]benzenecarbonitrile

Systemtic Name: 3-[[3-(4-fluoranyl-2-methyl-phenyl)-1-(2-pyrrolidin-1-ylethanoyl)piperidin-4-yl]oxymethyl]benzenecarbonitrile Openeye Name: 3-[[3-(4-fluoro-2-methyl-phenyl)-1-(2-pyrrolidin-1-ylacetyl)-4-piperidyl]oxymethyl]benzonitrile CAS Name: 3-[[3-(4-fluoro-2-methylphenyl)-1-[1-oxo-2-(1-pyrrolidinyl)ethyl]-4-piperidinyl]oxymethyl]benzonitrile IUPAC Name: 3-[[3-(4-fluoro-2-methylphenyl)-1-(2-pyrrolidin-1-ylacetyl)piperidin-4-yl]oxymethyl]benzonitrile Traditional Name: 3-[[3-(4-fluoro-2-methyl-phenyl)-1-(2-pyrrolidinoacetyl)-4-piperidyl]oxymethyl]benzonitrile Formula: C26H30FN3O2 MolecularWeight: 435.533703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)C2CN(CCC2OCC3=CC=CC(=C3)C#N)C(=O)CN4CCCC4

Isomeric SMILES

CC1=C(C=CC(=C1)F)C2CN(CCC2OCC3=CC=CC(=C3)C#N)C(=O)CN4CCCC4

InChI

InChI=1S/C26H30FN3O2/c1-19-13-22(27)7-8-23(19)24-16-30(26(31)17-29-10-2-3-11-29)12-9-25(24)32-18-21-6-4-5-20(14-21)15-28/h4-8,13-14,24-25H,2-3,9-12,16-18H2,1H3