butyl prop-2-enoate; 2-diphenylphosphanylethyl(diphenyl)phosphane; palladium

Systemtic Name: butyl prop-2-enoate; 2-diphenylphosphanylethyl(diphenyl)phosphane; palladium Openeye Name: butyl prop-2-enoate; 2-diphenylphosphanylethyl(diphenyl)phosphane; palladium CAS Name: 2-diphenylphosphinoethyl(diphenyl)phosphine; palladium; 2-propenoic acid butyl ester IUPAC Name: butyl prop-2-enoate; 2-diphenylphosphanylethyl(diphenyl)phosphane; palladium Traditional Name: acrylic acid butyl ester; 2-diphenylphosphinoethyl(diphenyl)phosphine; palladium Formula: C33H36O2P2Pd MolecularWeight: 633.005262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C=C.C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[Pd]

Isomeric SMILES

CCCCOC(=O)C=C.C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[Pd]

InChI

InChI=1S/C26H24P2.C7H12O2.Pd/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-3-5-6-9-7(8)4-2;/h1-20H,21-22H2;4H,2-3,5-6H2,1H3;