CHEBI:116954 - 1-azepanyl-[5-[(4-chloro-3,5-dimethylphenoxy)methyl]-3-isoxazolyl]methanone

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ChEBI Name 1-azepanyl-[5-[(4-chloro-3,5-dimethylphenoxy)methyl]-3-isoxazolyl]methanone
ChEBI ID CHEBI:116954
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C19H23ClN2O3
Net Charge 0
Average Mass 362.851
Monoisotopic Mass 362.13972
InChI InChI=1S/C19H23ClN2O3/c1-13-9-15(10-14(2)18(13)20)24-12-16-11-17(21-25-16)19(23)22-7-5-3-4-6-8-22/h9-11H,3-8,12H2,1-2H3
InChIKey XBOLVMCYOWDKMP-UHFFFAOYSA-N
SMILES CC1=CC(=CC(=C1Cl)C)OCC2=CC(=NO2)C(=O)N3CCCCCC3
ChEBI Ontology
Outgoing 1-azepanyl-[5-[(4-chloro-3,5-dimethylphenoxy)methyl]-3-isoxazolyl]methanone (CHEBI:116954) is a aromatic ether (CHEBI:35618)
Manual Xref Database
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