Benzoic acid, 4-heptyl-, 4-cyanophenyl ester
CAS Registry Number®
38690-76-5
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CAS Name
Benzoic acid, 4-heptyl-, 4-cyanophenyl esterMolecular Formula
C21H23NO2Molecular Mass
321.41Cite this Page
Benzoic acid, 4-heptyl-, 4-cyanophenyl ester. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=38690-76-5 (retrieved ) (CAS RN: 38690-76-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C21H23NO2/c1-2-3-4-5-6-7-17-8-12-19(13-9-17)21(23)24-20-14-10-18(16-22)11-15-20/h8-15H,2-7H2,1H3
InChIKey
InChIKey=ZWAUTNYPKHVAEZ-UHFFFAOYSA-N
SMILES
O(C(=O)C1=CC=C(CCCCCCC)C=C1)C2=CC=C(C#N)C=C2
Canonical SMILES
N#CC1=CC=C(OC(=O)C2=CC=C(C=C2)CCCCCCC)C=C1
Other Names for this Substance
- Benzoic acid, 4-heptyl-, 4-cyanophenyl ester
- 4-Cyanophenyl 4-heptylbenzoate
- p′-Cyanophenyl p-heptylbenzoate
- p-Cyanophenyl p-heptylbenzoate
- 4′-Cyanophenyl 4-heptylbenzoate
