2-chloranyl-2-(3-ethoxy-4-pentoxy-phenyl)ethanenitrile

Systemtic Name: 2-chloranyl-2-(3-ethoxy-4-pentoxy-phenyl)ethanenitrile Openeye Name: 2-chloro-2-(3-ethoxy-4-pentoxy-phenyl)acetonitrile CAS Name: 2-chloro-2-(3-ethoxy-4-pentoxyphenyl)acetonitrile IUPAC Name: 2-chloro-2-(3-ethoxy-4-pentoxyphenyl)acetonitrile Traditional Name: 2-(4-amoxy-3-ethoxy-phenyl)-2-chloro-acetonitrile Formula: C15H20ClNO2 MolecularWeight: 281.7778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)C(C#N)Cl)OCC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)C(C#N)Cl)OCC

InChI

InChI=1S/C15H20ClNO2/c1-3-5-6-9-19-14-8-7-12(13(16)11-17)10-15(14)18-4-2/h7-8,10,13H,3-6,9H2,1-2H3