CHEBI:120620 - 1-[4-[[4-(2-chloro-6-nitrophenoxy)phenyl]methoxy]phenyl]ethanone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-[4-[[4-(2-chloro-6-nitrophenoxy)phenyl]methoxy]phenyl]ethanone
ChEBI ID CHEBI:120620
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C21H16ClNO5
Net Charge 0
Average Mass 397.809
Monoisotopic Mass 397.07170
InChI InChI=1S/C21H16ClNO5/c1-14(24)16-7-11-17(12-8-16)27-13-15-5-9-18(10-6-15)28-21-19(22)3-2-4-20(21)23(25)26/h2-12H,13H2,1H3
InChIKey QOHUQCONBIESPG-UHFFFAOYSA-N
SMILES CC(=O)C1=CC=C(C=C1)OCC2=CC=C(C=C2)OC3=C(C=CC=C3Cl)[N+](=O)[O-]
ChEBI Ontology
Outgoing 1-[4-[[4-(2-chloro-6-nitrophenoxy)phenyl]methoxy]phenyl]ethanone (CHEBI:120620) is a aromatic ether (CHEBI:35618)
Manual Xref Database
LSM-32062 LINCS
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