5-(5-ethyl-2-oxidanyl-phenoxy)pentanenitrile

Systemtic Name: 5-(5-ethyl-2-oxidanyl-phenoxy)pentanenitrile Openeye Name: 5-(5-ethyl-2-hydroxy-phenoxy)pentanenitrile CAS Name: 5-(5-ethyl-2-hydroxyphenoxy)pentanenitrile IUPAC Name: 5-(5-ethyl-2-hydroxyphenoxy)pentanenitrile Traditional Name: 5-(5-ethyl-2-hydroxy-phenoxy)valeronitrile Formula: C13H17NO2 MolecularWeight: 219.27958

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)O)OCCCCC#N

Isomeric SMILES

CCC1=CC(=C(C=C1)O)OCCCCC#N

InChI

InChI=1S/C13H17NO2/c1-2-11-6-7-12(15)13(10-11)16-9-5-3-4-8-14/h6-7,10,15H,2-5,9H2,1H3