3-[[4-(3-oxidanylbutyl)phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 3-[[4-(3-oxidanylbutyl)phenoxy]methyl]benzenecarbonitrile Openeye Name: 3-[[4-(3-hydroxybutyl)phenoxy]methyl]benzonitrile CAS Name: 3-[[4-(3-hydroxybutyl)phenoxy]methyl]benzonitrile IUPAC Name: 3-[[4-(3-hydroxybutyl)phenoxy]methyl]benzonitrile Traditional Name: 3-[[4-(3-hydroxybutyl)phenoxy]methyl]benzonitrile Formula: C18H19NO2 MolecularWeight: 281.34896

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)OCC2=CC=CC(=C2)C#N)O

Isomeric SMILES

CC(CCC1=CC=C(C=C1)OCC2=CC=CC(=C2)C#N)O

InChI

InChI=1S/C18H19NO2/c1-14(20)5-6-15-7-9-18(10-8-15)21-13-17-4-2-3-16(11-17)12-19/h2-4,7-11,14,20H,5-6,13H2,1H3