triphenyl-[(3-propan-2-yloxycarbonylfuran-2-yl)methyl]phosphanium chloride

Systemtic Name: triphenyl-[(3-propan-2-yloxycarbonylfuran-2-yl)methyl]phosphanium chloride Openeye Name: (3-isopropoxycarbonyl-2-furyl)methyl-triphenyl-phosphonium chloride CAS Name: [3-[oxo(propan-2-yloxy)methyl]-2-furanyl]methyl-triphenylphosphonium chloride IUPAC Name: triphenyl-[(3-propan-2-yloxycarbonylfuran-2-yl)methyl]phosphanium chloride Traditional Name: (3-isopropoxycarbonyl-2-furyl)methyl-triphenyl-phosphonium chloride Formula: C27H26ClO3P MolecularWeight: 464.920301

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(OC=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

CC(C)OC(=O)C1=C(OC=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C27H26O3P.ClH/c1-21(2)30-27(28)25-18-19-29-26(25)20-31(22-12-6-3-7-13-22,23-14-8-4-9-15-23)24-16-10-5-11-17-24;/h3-19,21H,20H2,1-2H3;1H/q+1;/p-1