5-[4-ethanoyl-5-oxidanyl-2-(oxiran-2-ylmethyl)phenoxy]pentanenitrile

Systemtic Name: 5-[4-ethanoyl-5-oxidanyl-2-(oxiran-2-ylmethyl)phenoxy]pentanenitrile Openeye Name: 5-[4-acetyl-5-hydroxy-2-(oxiran-2-ylmethyl)phenoxy]pentanenitrile CAS Name: 5-[4-acetyl-5-hydroxy-2-(2-oxiranylmethyl)phenoxy]pentanenitrile IUPAC Name: 5-[4-acetyl-5-hydroxy-2-(oxiran-2-ylmethyl)phenoxy]pentanenitrile Traditional Name: 5-(4-acetyl-2-glycidyl-5-hydroxy-phenoxy)valeronitrile Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1O)OCCCCC#N)CC2CO2

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1O)OCCCCC#N)CC2CO2

InChI

InChI=1S/C16H19NO4/c1-11(18)14-8-12(7-13-10-21-13)16(9-15(14)19)20-6-4-2-3-5-17/h8-9,13,19H,2-4,6-7,10H2,1H3