2-(4-methoxy-3-oxidanyl-butoxy)-2-phenyl-ethanenitrile

Systemtic Name: 2-(4-methoxy-3-oxidanyl-butoxy)-2-phenyl-ethanenitrile Openeye Name: 2-(3-hydroxy-4-methoxy-butoxy)-2-phenyl-acetonitrile CAS Name: 2-(3-hydroxy-4-methoxybutoxy)-2-phenylacetonitrile IUPAC Name: 2-(3-hydroxy-4-methoxybutoxy)-2-phenylacetonitrile Traditional Name: 2-(3-hydroxy-4-methoxy-butoxy)-2-phenyl-acetonitrile Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

COCC(CCOC(C#N)C1=CC=CC=C1)O

Isomeric SMILES

COCC(CCOC(C#N)C1=CC=CC=C1)O

InChI

InChI=1S/C13H17NO3/c1-16-10-12(15)7-8-17-13(9-14)11-5-3-2-4-6-11/h2-6,12-13,15H,7-8,10H2,1H3