dimethyl (E)-but-2-enedioate; 1-(2-diphenylphosphanylphenyl)-N-(4-methoxyphenyl)methanimine; palladium

Systemtic Name: dimethyl (E)-but-2-enedioate; 1-(2-diphenylphosphanylphenyl)-N-(4-methoxyphenyl)methanimine; palladium Openeye Name: dimethyl (E)-but-2-enedioate; 1-(2-diphenylphosphanylphenyl)-N-(4-methoxyphenyl)methanimine; palladium CAS Name: (E)-2-butenedioic acid dimethyl ester; 1-(2-diphenylphosphinophenyl)-N-(4-methoxyphenyl)methanimine; palladium IUPAC Name: dimethyl (E)-but-2-enedioate; 1-(2-diphenylphosphanylphenyl)-N-(4-methoxyphenyl)methanimine; palladium Traditional Name: (E)-but-2-enedioic acid dimethyl ester; (2-diphenylphosphinobenzylidene)-(4-methoxyphenyl)amine; palladium Formula: C32H30NO5PPd MolecularWeight: 645.978061

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N=CC2=CC=CC=C2P(C3=CC=CC=C3)C4=CC=CC=C4.COC(=O)C=CC(=O)OC.[Pd]

Isomeric SMILES

COC1=CC=C(C=C1)N=CC2=CC=CC=C2P(C3=CC=CC=C3)C4=CC=CC=C4.COC(=O)/C=C/C(=O)OC.[Pd]

InChI

InChI=1S/C26H22NOP.C6H8O4.Pd/c1-28-23-18-16-22(17-19-23)27-20-21-10-8-9-15-26(21)29(24-11-4-2-5-12-24)25-13-6-3-7-14-25;1-9-5(7)3-4-6(8)10-2;/h2-20H,1H3;3-4H,1-2H3;/b;4-3+;