3-(4-methoxyphenyl)-5-[2-(4-phenylpyridin-1-ium-1-yl)ethyl]-1,3-oxazolidin-2-one bromide

Systemtic Name: 3-(4-methoxyphenyl)-5-[2-(4-phenylpyridin-1-ium-1-yl)ethyl]-1,3-oxazolidin-2-one bromide Openeye Name: 3-(4-methoxyphenyl)-5-[2-(4-phenylpyridin-1-ium-1-yl)ethyl]oxazolidin-2-one bromide CAS Name: 3-(4-methoxyphenyl)-5-[2-(4-phenyl-1-pyridin-1-iumyl)ethyl]-2-oxazolidinone bromide IUPAC Name: 3-(4-methoxyphenyl)-5-[2-(4-phenylpyridin-1-ium-1-yl)ethyl]-1,3-oxazolidin-2-one bromide Traditional Name: 3-(4-methoxyphenyl)-5-[2-(4-phenylpyridin-1-ium-1-yl)ethyl]oxazolidin-2-one bromide Formula: C23H23BrN2O3 MolecularWeight: 455.34432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC(OC2=O)CC[N+]3=CC=C(C=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

COC1=CC=C(C=C1)N2CC(OC2=O)CC[N+]3=CC=C(C=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C23H23N2O3.BrH/c1-27-21-9-7-20(8-10-21)25-17-22(28-23(25)26)13-16-24-14-11-19(12-15-24)18-5-3-2-4-6-18;/h2-12,14-15,22H,13,16-17H2,1H3;1H/q+1;/p-1