benzene; 1,3-diethoxy-2-phenyl-propane-1,3-diol; palladium; triphenylphosphanium

Systemtic Name: benzene; 1,3-diethoxy-2-phenyl-propane-1,3-diol; palladium; triphenylphosphanium Openeye Name: benzene; 1,3-diethoxy-2-phenyl-propane-1,3-diol; palladium; triphenylphosphonium CAS Name: benzene; 1,3-diethoxy-2-phenylpropane-1,3-diol; palladium; triphenylphosphonium IUPAC Name: benzene; 1,3-diethoxy-2-phenylpropane-1,3-diol; palladium; triphenylphosphanium Traditional Name: benzene; 1,3-diethoxy-2-phenyl-propane-1,3-diol; palladium; triphenylphosphonium Formula: C37H41O4PPd MolecularWeight: 687.112801

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(C1=CC=CC=C1)C(O)OCC)O.C1=CC=[C-]C=C1.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.[Pd]

Isomeric SMILES

CCOC(C(C1=CC=CC=C1)C(O)OCC)O.C1=CC=[C-]C=C1.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.[Pd]

InChI

InChI=1S/C18H15P.C13H20O4.C6H5.Pd/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-16-12(14)11(13(15)17-4-2)10-8-6-5-7-9-10;1-2-4-6-5-3-1;/h1-15H;5-9,11-15H,3-4H2,1-2H3;1-5H;/q;;-1;/p+1