CHEBI:31321 - Bunitrolol hydrochloride

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ChEBI Name Bunitrolol hydrochloride ChEBI ID CHEBI:31321 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formulae C14H21ClN2O2 C14H21N2O2.Cl Net Charge 0 Average Mass 284.782 Monoisotopic Mass 284.12916 InChI InChI=1S/C14H20N2O2.ClH/c1-14(2,3)16-9-12(17)10-18-13-7-5-4-6-11(13)8-15;/h4-7,12,16-17H,9-10H2,1-3H3;1H InChIKey RJPWESHPIMRNNM-UHFFFAOYSA-N SMILES Cl.C=1C=C(OCC(CNC(C)(C)C)O)C(C#N)=CC1 ChEBI Ontology Outgoing Bunitrolol hydrochloride (CHEBI:31321) is a aromatic ether (CHEBI:35618) Synonym Source Bunitrolol hydrochloride KEGG COMPOUND Manual Xref Database D01444 KEGG DRUG View more database links Registry Number Type Source 29876-08-2 CAS Registry Number KEGG COMPOUND Last Modified 06 March 2017