2-[2-(cyclohexyl-oxidanyl-phenyl-methyl)-1,3-oxazol-5-yl]ethyl-dimethyl-(2-phenoxyethyl)azanium bromide

Systemtic Name: 2-[2-(cyclohexyl-oxidanyl-phenyl-methyl)-1,3-oxazol-5-yl]ethyl-dimethyl-(2-phenoxyethyl)azanium bromide Openeye Name: 2-[2-(cyclohexyl-hydroxy-phenyl-methyl)oxazol-5-yl]ethyl-dimethyl-(2-phenoxyethyl)ammonium bromide CAS Name: 2-[2-(cyclohexyl-hydroxy-phenylmethyl)-5-oxazolyl]ethyl-dimethyl-(2-phenoxyethyl)ammonium bromide IUPAC Name: 2-[2-(cyclohexyl-hydroxy-phenylmethyl)-1,3-oxazol-5-yl]ethyl-dimethyl-(2-phenoxyethyl)azanium bromide Traditional Name: 2-[2-(cyclohexyl-hydroxy-phenyl-methyl)oxazol-5-yl]ethyl-dimethyl-(2-phenoxyethyl)ammonium bromide Formula: C28H37BrN2O3 MolecularWeight: 529.50898

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCC1=CN=C(O1)C(C2CCCCC2)(C3=CC=CC=C3)O)CCOC4=CC=CC=C4.[Br-]

Isomeric SMILES

C[N+](C)(CCC1=CN=C(O1)C(C2CCCCC2)(C3=CC=CC=C3)O)CCOC4=CC=CC=C4.[Br-]

InChI

InChI=1S/C28H37N2O3.BrH/c1-30(2,20-21-32-25-16-10-5-11-17-25)19-18-26-22-29-27(33-26)28(31,23-12-6-3-7-13-23)24-14-8-4-9-15-24;/h3,5-7,10-13,16-17,22,24,31H,4,8-9,14-15,18-21H2,1-2H3;1H/q+1;/p-1