dimethyl (E)-but-2-enedioate; 1-(2-diphenylphosphanylphenyl)-N-phenyl-methanimine; palladium

Systemtic Name: dimethyl (E)-but-2-enedioate; 1-(2-diphenylphosphanylphenyl)-N-phenyl-methanimine; palladium Openeye Name: dimethyl (E)-but-2-enedioate; 1-(2-diphenylphosphanylphenyl)-N-phenyl-methanimine; palladium CAS Name: (E)-2-butenedioic acid dimethyl ester; 1-(2-diphenylphosphinophenyl)-N-phenylmethanimine; palladium IUPAC Name: dimethyl (E)-but-2-enedioate; 1-(2-diphenylphosphanylphenyl)-N-phenylmethanimine; palladium Traditional Name: (E)-but-2-enedioic acid dimethyl ester; (2-diphenylphosphinobenzylidene)-phenyl-amine; palladium Formula: C31H28NO4PPd MolecularWeight: 615.952081

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC(=O)OC.C1=CC=C(C=C1)N=CC2=CC=CC=C2P(C3=CC=CC=C3)C4=CC=CC=C4.[Pd]

Isomeric SMILES

COC(=O)/C=C/C(=O)OC.C1=CC=C(C=C1)N=CC2=CC=CC=C2P(C3=CC=CC=C3)C4=CC=CC=C4.[Pd]

InChI

InChI=1S/C25H20NP.C6H8O4.Pd/c1-4-13-22(14-5-1)26-20-21-12-10-11-19-25(21)27(23-15-6-2-7-16-23)24-17-8-3-9-18-24;1-9-5(7)3-4-6(8)10-2;/h1-20H;3-4H,1-2H3;/b;4-3+;