2-[4-(dimethylamino)-1-(4-fluorophenyl)-1-oxidanyl-butyl]-3-(hydroxymethyl)benzenecarbonitrile

Systemtic Name: 2-[4-(dimethylamino)-1-(4-fluorophenyl)-1-oxidanyl-butyl]-3-(hydroxymethyl)benzenecarbonitrile Openeye Name: 2-[4-(dimethylamino)-1-(4-fluorophenyl)-1-hydroxy-butyl]-3-(hydroxymethyl)benzonitrile CAS Name: 2-[4-(dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl]-3-(hydroxymethyl)benzonitrile IUPAC Name: 2-[4-(dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl]-3-(hydroxymethyl)benzonitrile Traditional Name: 2-[4-(dimethylamino)-1-(4-fluorophenyl)-1-hydroxy-butyl]-3-methylol-benzonitrile Formula: C20H23FN2O2 MolecularWeight: 342.407223

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCC(C1=CC=C(C=C1)F)(C2=C(C=CC=C2CO)C#N)O

Isomeric SMILES

CN(C)CCCC(C1=CC=C(C=C1)F)(C2=C(C=CC=C2CO)C#N)O

InChI

InChI=1S/C20H23FN2O2/c1-23(2)12-4-11-20(25,17-7-9-18(21)10-8-17)19-15(13-22)5-3-6-16(19)14-24/h3,5-10,24-25H,4,11-12,14H2,1-2H3