CHEBI:116381 - 2,3-dihydro-1,4-dioxin-5-carboxylic acid [2-[4-[4-(2-methylbutan-2-yl)phenoxy]anilino]-2-oxoethyl] ester

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2,3-dihydro-1,4-dioxin-5-carboxylic acid [2-[4-[4-(2-methylbutan-2-yl)phenoxy]anilino]-2-oxoethyl] ester
ChEBI ID CHEBI:116381
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C24H27NO6
Net Charge 0
Average Mass 425.475
Monoisotopic Mass 425.18384
InChI InChI=1S/C24H27NO6/c1-4-24(2,3)17-5-9-19(10-6-17)31-20-11-7-18(8-12-20)25-22(26)16-30-23(27)21-15-28-13-14-29-21/h5-12,15H,4,13-14,16H2,1-3H3,(H,25,26)
InChIKey CKTLEGBRDQGLJY-UHFFFAOYSA-N
SMILES CCC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)COC(=O)C3=COCCO3
ChEBI Ontology
Outgoing 2,3-dihydro-1,4-dioxin-5-carboxylic acid [2-[4-[4-(2-methylbutan-2-yl)phenoxy]anilino]-2-oxoethyl] ester (CHEBI:116381) is a aromatic ether (CHEBI:35618)
Manual Xref Database
LSM-27835 LINCS
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