CHEBI:104926 - 5-(1-azepanyl)-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile

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ChEBI Name 5-(1-azepanyl)-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile
ChEBI ID CHEBI:104926
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C18H21N3O3
Net Charge 0
Average Mass 327.378
Monoisotopic Mass 327.15829
InChI InChI=1S/C18H21N3O3/c1-22-15-8-7-13(11-16(15)23-2)17-20-14(12-19)18(24-17)21-9-5-3-4-6-10-21/h7-8,11H,3-6,9-10H2,1-2H3
InChIKey ZKMSQFNCYCQUPB-UHFFFAOYSA-N
SMILES COC1=C(C=C(C=C1)C2=NC(=C(O2)N3CCCCCC3)C#N)OC
ChEBI Ontology
Outgoing 5-(1-azepanyl)-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile (CHEBI:104926) is a 1,3-oxazoles (CHEBI:46812)
Manual Xref Database
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