(4-methyl-1,3-benzoxazol-2-yl)methyl-triphenyl-phosphanium chloride

Systemtic Name: (4-methyl-1,3-benzoxazol-2-yl)methyl-triphenyl-phosphanium chloride Openeye Name: (4-methyl-1,3-benzoxazol-2-yl)methyl-triphenyl-phosphonium chloride CAS Name: (4-methyl-1,3-benzoxazol-2-yl)methyl-triphenylphosphonium chloride IUPAC Name: (4-methyl-1,3-benzoxazol-2-yl)methyl-triphenylphosphanium chloride Traditional Name: (4-methyl-1,3-benzoxazol-2-yl)methyl-triphenyl-phosphonium chloride Formula: C27H23ClNOP MolecularWeight: 443.904381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)OC(=N2)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Cl-]

Isomeric SMILES

CC1=C2C(=CC=C1)OC(=N2)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Cl-]

InChI

InChI=1S/C27H23NOP.ClH/c1-21-12-11-19-25-27(21)28-26(29-25)20-30(22-13-5-2-6-14-22,23-15-7-3-8-16-23)24-17-9-4-10-18-24;/h2-19H,20H2,1H3;1H/q+1;/p-1