4-[[2-[(3-hydroxyphenyl)methylidene]-1-adamantyl]oxy]butanenitrile

Systemtic Name: 4-[[2-[(3-hydroxyphenyl)methylidene]-1-adamantyl]oxy]butanenitrile Openeye Name: 4-[[2-[(3-hydroxyphenyl)methylene]-1-adamantyl]oxy]butanenitrile CAS Name: 4-[[2-[(3-hydroxyphenyl)methylidene]-1-adamantyl]oxy]butanenitrile IUPAC Name: 4-[[2-[(3-hydroxyphenyl)methylidene]-1-adamantyl]oxy]butanenitrile Traditional Name: 4-[[2-(3-hydroxybenzylidene)-1-adamantyl]oxy]butyronitrile Formula: C21H25NO2 MolecularWeight: 323.4287

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3=CC4=CC(=CC=C4)O)OCCCC#N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3=CC4=CC(=CC=C4)O)OCCCC#N

InChI

InChI=1S/C21H25NO2/c22-6-1-2-7-24-21-13-16-8-17(14-21)10-18(9-16)20(21)12-15-4-3-5-19(23)11-15/h3-5,11-12,16-18,23H,1-2,7-10,13-14H2