[2-(1,1-diphenylethyl)-1,3-oxazol-5-yl]methyl-dimethyl-(3-phenoxypropyl)azanium bromide

Systemtic Name: [2-(1,1-diphenylethyl)-1,3-oxazol-5-yl]methyl-dimethyl-(3-phenoxypropyl)azanium bromide Openeye Name: [2-(1,1-diphenylethyl)oxazol-5-yl]methyl-dimethyl-(3-phenoxypropyl)ammonium bromide CAS Name: [2-(1,1-diphenylethyl)-5-oxazolyl]methyl-dimethyl-(3-phenoxypropyl)ammonium bromide IUPAC Name: [2-(1,1-diphenylethyl)-1,3-oxazol-5-yl]methyl-dimethyl-(3-phenoxypropyl)azanium bromide Traditional Name: [2-(1,1-diphenylethyl)oxazol-5-yl]methyl-dimethyl-(3-phenoxypropyl)ammonium bromide Formula: C29H33BrN2O2 MolecularWeight: 521.48852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=NC=C(O3)C[N+](C)(C)CCCOC4=CC=CC=C4.[Br-]

Isomeric SMILES

CC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=NC=C(O3)C[N+](C)(C)CCCOC4=CC=CC=C4.[Br-]

InChI

InChI=1S/C29H33N2O2.BrH/c1-29(24-14-7-4-8-15-24,25-16-9-5-10-17-25)28-30-22-27(33-28)23-31(2,3)20-13-21-32-26-18-11-6-12-19-26;/h4-12,14-19,22H,13,20-21,23H2,1-3H3;1H/q+1;/p-1