5-(phenylmethyl)-3-pyridin-1-ium-2-yl-2H-1,3-oxazole bromide

Systemtic Name: 5-(phenylmethyl)-3-pyridin-1-ium-2-yl-2H-1,3-oxazole bromide Openeye Name: 5-benzyl-3-pyridin-1-ium-2-yl-2H-oxazole bromide CAS Name: 5-(phenylmethyl)-3-(2-pyridin-1-iumyl)-2H-oxazole bromide IUPAC Name: 5-benzyl-3-pyridin-1-ium-2-yl-2H-1,3-oxazole bromide Traditional Name: 5-benzyl-3-pyridin-1-ium-2-yl-4-oxazoline bromide Formula: C15H15BrN2O MolecularWeight: 319.1964

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Descriptors Computed from Structure

Canonical SMILES:

C1N(C=C(O1)CC2=CC=CC=C2)C3=CC=CC=[NH+]3.[Br-]

Isomeric SMILES

C1N(C=C(O1)CC2=CC=CC=C2)C3=CC=CC=[NH+]3.[Br-]

InChI

InChI=1S/C15H14N2O.BrH/c1-2-6-13(7-3-1)10-14-11-17(12-18-14)15-8-4-5-9-16-15;/h1-9,11H,10,12H2;1H