2-(3-chlorophenyl)-5-ethoxy-3-oxidanylidene-pentanenitrile

Systemtic Name: 2-(3-chlorophenyl)-5-ethoxy-3-oxidanylidene-pentanenitrile Openeye Name: 2-(3-chlorophenyl)-5-ethoxy-3-oxo-pentanenitrile CAS Name: 2-(3-chlorophenyl)-5-ethoxy-3-oxopentanenitrile IUPAC Name: 2-(3-chlorophenyl)-5-ethoxy-3-oxopentanenitrile Traditional Name: 2-(3-chlorophenyl)-5-ethoxy-3-keto-valeronitrile Formula: C13H14ClNO2 MolecularWeight: 251.70876

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCC(=O)C(C#N)C1=CC(=CC=C1)Cl

Isomeric SMILES

CCOCCC(=O)C(C#N)C1=CC(=CC=C1)Cl

InChI

InChI=1S/C13H14ClNO2/c1-2-17-7-6-13(16)12(9-15)10-4-3-5-11(14)8-10/h3-5,8,12H,2,6-7H2,1H3