5-(4-ethanoyl-2-ethyl-5-oxidanyl-phenoxy)pentanenitrile

Systemtic Name: 5-(4-ethanoyl-2-ethyl-5-oxidanyl-phenoxy)pentanenitrile Openeye Name: 5-(4-acetyl-2-ethyl-5-hydroxy-phenoxy)pentanenitrile CAS Name: 5-(4-acetyl-2-ethyl-5-hydroxyphenoxy)pentanenitrile IUPAC Name: 5-(4-acetyl-2-ethyl-5-hydroxyphenoxy)pentanenitrile Traditional Name: 5-(4-acetyl-2-ethyl-5-hydroxy-phenoxy)valeronitrile Formula: C15H19NO3 MolecularWeight: 261.31626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO3/c1-3-12-9-13(11(2)17)14(18)10-15(12)19-8-6-4-5-7-16/h9-10,18H,3-6,8H2,1-2H3