5-piperidin-4-yl-4-thiophen-3-yl-1,2-oxazol-3-one hydrobromide

Systemtic Name: 5-piperidin-4-yl-4-thiophen-3-yl-1,2-oxazol-3-one hydrobromide Openeye Name: 5-(4-piperidyl)-4-(3-thienyl)isoxazol-3-one hydrobromide CAS Name: 5-(4-piperidinyl)-4-(3-thiophenyl)-3-isoxazolone hydrobromide IUPAC Name: 5-piperidin-4-yl-4-thiophen-3-yl-1,2-oxazol-3-one hydrobromide Traditional Name: 5-(4-piperidyl)-4-(3-thienyl)-4-isoxazolin-3-one hydrobromide Formula: C12H15BrN2O2S MolecularWeight: 331.2287

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=C(C(=O)NO2)C3=CSC=C3.Br

Isomeric SMILES

C1CNCCC1C2=C(C(=O)NO2)C3=CSC=C3.Br

InChI

InChI=1S/C12H14N2O2S.BrH/c15-12-10(9-3-6-17-7-9)11(16-14-12)8-1-4-13-5-2-8;/h3,6-8,13H,1-2,4-5H2,(H,14,15);1H