5-methyl-2-phenyl-4-[1-(phenylmethyl)pyridin-1-ium-4-yl]-1,3-oxazole bromide

Systemtic Name: 5-methyl-2-phenyl-4-[1-(phenylmethyl)pyridin-1-ium-4-yl]-1,3-oxazole bromide Openeye Name: 4-(1-benzylpyridin-1-ium-4-yl)-5-methyl-2-phenyl-oxazole bromide CAS Name: 5-methyl-2-phenyl-4-[1-(phenylmethyl)-4-pyridin-1-iumyl]oxazole bromide IUPAC Name: 4-(1-benzylpyridin-1-ium-4-yl)-5-methyl-2-phenyl-1,3-oxazole bromide Traditional Name: 4-(1-benzylpyridin-1-ium-4-yl)-5-methyl-2-phenyl-oxazole bromide Formula: C22H19BrN2O MolecularWeight: 407.30306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)C3=CC=[N+](C=C3)CC4=CC=CC=C4.[Br-]

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)C3=CC=[N+](C=C3)CC4=CC=CC=C4.[Br-]

InChI

InChI=1S/C22H19N2O.BrH/c1-17-21(23-22(25-17)20-10-6-3-7-11-20)19-12-14-24(15-13-19)16-18-8-4-2-5-9-18;/h2-15H,16H2,1H3;1H/q+1;/p-1