5-[5-(4-cyanobutoxy)-4-ethanoyl-2-(hydroxymethyl)phenoxy]pentanenitrile

Systemtic Name: 5-[5-(4-cyanobutoxy)-4-ethanoyl-2-(hydroxymethyl)phenoxy]pentanenitrile Openeye Name: 5-[4-acetyl-5-(4-cyanobutoxy)-2-(hydroxymethyl)phenoxy]pentanenitrile CAS Name: 5-[4-acetyl-5-(4-cyanobutoxy)-2-(hydroxymethyl)phenoxy]pentanenitrile IUPAC Name: 5-[4-acetyl-5-(4-cyanobutoxy)-2-(hydroxymethyl)phenoxy]pentanenitrile Traditional Name: 5-[4-acetyl-5-(4-cyanobutoxy)-2-methylol-phenoxy]valeronitrile Formula: C19H24N2O4 MolecularWeight: 344.40486

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1OCCCCC#N)OCCCCC#N)CO

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1OCCCCC#N)OCCCCC#N)CO

InChI

InChI=1S/C19H24N2O4/c1-15(23)17-12-16(14-22)18(24-10-6-2-4-8-20)13-19(17)25-11-7-3-5-9-21/h12-13,22H,2-7,10-11,14H2,1H3