loading...| Preferred Name |
CTPB |
| Synonyms |
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-ethoxy-6-pentadecylbenzamide |
| Definitions |
A benzamide obtained by formal condensation of the carboxy group of 2-ethoxy-6-pentadecylbenzoic acid with one of the amino groups of 4-chloro-3-(trifluoromethyl)aniline. |
| ID |
http://purl.obolibrary.org/obo/CHEBI_90203 |
| charge |
0 |
| database_cross_reference |
PMID:26365427 Reaxys:12644409 LINCS:LSM-37088 PMID:23770402 |
| definition |
A benzamide obtained by formal condensation of the carboxy group of 2-ethoxy-6-pentadecylbenzoic acid with one of the amino groups of 4-chloro-3-(trifluoromethyl)aniline. |
| formula |
C31H43ClF3NO2 |
| has role | |
| has_exact_synonym |
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-ethoxy-6-pentadecylbenzamide |
| has_obo_namespace |
chebi_ontology |
| id |
CHEBI:90203 |
| in_subset | |
| inchi |
InChI=1S/C31H43ClF3NO2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-18-24-19-17-20-28(38-4-2)29(24)30(37)36-25-21-22-27(32)26(23-25)31(33,34)35/h17,19-23H,3-16,18H2,1-2H3,(H,36,37) |
| inchikey |
OYBMVMAXKOGYDC-UHFFFAOYSA-N |
| label |
CTPB |
| mass |
554.128 |
| monoisotopicmass |
553.29344 |
| notation |
CHEBI:90203 |
| prefLabel |
CTPB |
| smiles |
C(=O)(C1=C(C=CC=C1CCCCCCCCCCCCCCC)OCC)NC2=CC=C(C(=C2)C(F)(F)F)Cl |
| treeView |
http://purl.obolibrary.org/obo/CHEBI_22702 http://purl.obolibrary.org/obo/CHEBI_35618 |
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_22702 http://purl.obolibrary.org/obo/CHEBI_35618 |
| Delete | Mapping To | Ontology | Source |
|---|---|---|---|
| http://purl.obolibrary.org/obo/OGG_3000886928 | Ontology of Genes and Genomes / 基因和基因组本体 | LOOM |