(4R,5S)-4,5-dimethoxy-4-methyl-2,5-diphenyl-1,3-oxazol-3-ium bromide

Systemtic Name: (4R,5S)-4,5-dimethoxy-4-methyl-2,5-diphenyl-1,3-oxazol-3-ium bromide Openeye Name: (4R,5S)-4,5-dimethoxy-4-methyl-2,5-diphenyl-oxazol-3-ium bromide CAS Name: (4R,5S)-4,5-dimethoxy-4-methyl-2,5-diphenyloxazol-3-ium bromide IUPAC Name: (4R,5S)-4,5-dimethoxy-4-methyl-2,5-diphenyl-1,3-oxazol-3-ium bromide Traditional Name: (4R,5S)-4,5-dimethoxy-4-methyl-2,5-diphenyl-2-oxazolin-3-ium bromide Formula: C18H20BrNO3 MolecularWeight: 378.2603

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(OC(=[NH+]1)C2=CC=CC=C2)(C3=CC=CC=C3)OC)OC.[Br-]

Isomeric SMILES

C[C@]1([C@@](OC(=[NH+]1)C2=CC=CC=C2)(C3=CC=CC=C3)OC)OC.[Br-]

InChI

InChI=1S/C18H19NO3.BrH/c1-17(20-2)18(21-3,15-12-8-5-9-13-15)22-16(19-17)14-10-6-4-7-11-14;/h4-13H,1-3H3;1H/t17-,18+;/m1./s1