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

Systemtic Name: 5-(4-ethanoyl-2-methyl-5-oxidanyl-phenoxy)pentanenitrile Openeye Name: 5-(4-acetyl-5-hydroxy-2-methyl-phenoxy)pentanenitrile CAS Name: 5-(4-acetyl-5-hydroxy-2-methylphenoxy)pentanenitrile IUPAC Name: 5-(4-acetyl-5-hydroxy-2-methylphenoxy)pentanenitrile Traditional Name: 5-(4-acetyl-5-hydroxy-2-methyl-phenoxy)valeronitrile Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)C(=O)C)O)OCCCCC#N

Isomeric SMILES

CC1=C(C=C(C(=C1)C(=O)C)O)OCCCCC#N

InChI

InChI=1S/C14H17NO3/c1-10-8-12(11(2)16)13(17)9-14(10)18-7-5-3-4-6-15/h8-9,17H,3-5,7H2,1-2H3