[3-methyl-5-(4-methylphenyl)-1,2-oxazol-4-yl]methyl-triphenyl-phosphanium chloride

Systemtic Name: [3-methyl-5-(4-methylphenyl)-1,2-oxazol-4-yl]methyl-triphenyl-phosphanium chloride Openeye Name: [3-methyl-5-(p-tolyl)isoxazol-4-yl]methyl-triphenyl-phosphonium chloride CAS Name: [3-methyl-5-(4-methylphenyl)-4-isoxazolyl]methyl-triphenylphosphonium chloride IUPAC Name: [3-methyl-5-(4-methylphenyl)-1,2-oxazol-4-yl]methyl-triphenylphosphanium chloride Traditional Name: [3-methyl-5-(p-tolyl)isoxazol-4-yl]methyl-triphenyl-phosphonium chloride Formula: C30H27ClNOP MolecularWeight: 483.968241

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=NO2)C)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Cl-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=NO2)C)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Cl-]

InChI

InChI=1S/C30H27NOP.ClH/c1-23-18-20-25(21-19-23)30-29(24(2)31-32-30)22-33(26-12-6-3-7-13-26,27-14-8-4-9-15-27)28-16-10-5-11-17-28;/h3-21H,22H2,1-2H3;1H/q+1;/p-1