4-(phenylmethyl)-5-piperidin-4-yl-1,2-oxazol-3-one bromide

Systemtic Name: 4-(phenylmethyl)-5-piperidin-4-yl-1,2-oxazol-3-one bromide Openeye Name: 4-benzyl-5-(4-piperidyl)isoxazol-3-one bromide CAS Name: 4-(phenylmethyl)-5-(4-piperidinyl)-3-isoxazolone bromide IUPAC Name: 4-benzyl-5-piperidin-4-yl-1,2-oxazol-3-one bromide Traditional Name: 4-benzyl-5-(4-piperidyl)-4-isoxazolin-3-one bromide Formula: C15H18BrN2O2- MolecularWeight: 338.21962

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=C(C(=O)NO2)CC3=CC=CC=C3.[Br-]

Isomeric SMILES

C1CNCCC1C2=C(C(=O)NO2)CC3=CC=CC=C3.[Br-]

InChI

InChI=1S/C15H18N2O2.BrH/c18-15-13(10-11-4-2-1-3-5-11)14(19-17-15)12-6-8-16-9-7-12;/h1-5,12,16H,6-10H2,(H,17,18);1H/p-1