5-(4-ethanoyl-3-oxidanyl-phenoxy)pentanenitrile

Systemtic Name: 5-(4-ethanoyl-3-oxidanyl-phenoxy)pentanenitrile Openeye Name: 5-(4-acetyl-3-hydroxy-phenoxy)pentanenitrile CAS Name: 5-(4-acetyl-3-hydroxyphenoxy)pentanenitrile IUPAC Name: 5-(4-acetyl-3-hydroxyphenoxy)pentanenitrile Traditional Name: 5-(4-acetyl-3-hydroxy-phenoxy)valeronitrile Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO3/c1-10(15)12-6-5-11(9-13(12)16)17-8-4-2-3-7-14/h5-6,9,16H,2-4,8H2,1H3