4-[3-(4-Chlorophenyl)-1-oxopropyl]benzonitrile
CAS Registry Number®
898787-70-7
CAS Name
4-[3-(4-Chlorophenyl)-1-oxopropyl]benzonitrileMolecular Formula
C16H12ClNOMolecular Mass
269.73Cite this Page
4-[3-(4-Chlorophenyl)-1-oxopropyl]benzonitrile. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=898787-70-7 (retrieved ) (CAS RN: 898787-70-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C16H12ClNO/c17-15-8-3-12(4-9-15)5-10-16(19)14-6-1-13(11-18)2-7-14/h1-4,6-9H,5,10H2
InChIKey
InChIKey=ZBMOXMDLHXZSRK-UHFFFAOYSA-N
SMILES
C(CCC1=CC=C(Cl)C=C1)(=O)C2=CC=C(C#N)C=C2
Canonical SMILES
N#CC1=CC=C(C=C1)C(=O)CCC2=CC=C(Cl)C=C2
Other Names for this Substance
- Benzonitrile, 4-[3-(4-chlorophenyl)-1-oxopropyl]-
- 4-[3-(4-Chlorophenyl)-1-oxopropyl]benzonitrile