CHEBI:105763 - N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide

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ChEBI Name N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide
ChEBI ID CHEBI:105763
Stars This entity has been manually annotated by a third party.
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Formula C27H25FN2O5
Net Charge 0
Average Mass 476.497
Monoisotopic Mass 476.17475
InChI InChI=1S/C27H25FN2O5/c1-33-13-12-30-25(17-6-8-18(28)9-7-17)24(20-4-2-3-5-21(20)27(30)32)26(31)29-19-10-11-22-23(16-19)35-15-14-34-22/h2-11,16,24-25H,12-15H2,1H3,(H,29,31)
InChIKey YKILRQIFJMFKJA-UHFFFAOYSA-N
SMILES COCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NC3=CC4=C(C=C3)OCCO4)C5=CC=C(C=C5)F
ChEBI Ontology
Outgoing N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide (CHEBI:105763) is a isoquinolines (CHEBI:24922)
Manual Xref Database
LSM-17125 LINCS
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