1-ethoxy-2-ethoxycarbonyl-4-(8-oxidaniumylquinolin-2-yl)but-1-en-1-olate; palladium(2+); pyridine

Systemtic Name: 1-ethoxy-2-ethoxycarbonyl-4-(8-oxidaniumylquinolin-2-yl)but-1-en-1-olate; palladium(2+); pyridine Openeye Name: 1-ethoxy-2-ethoxycarbonyl-4-(8-oxonio-2-quinolyl)but-1-en-1-olate; palladium(2+); pyridine CAS Name: 1-ethoxy-2-ethoxycarbonyl-4-(8-oxonio-2-quinolinyl)-1-buten-1-olate; palladium(2+); pyridine IUPAC Name: 1-ethoxy-2-ethoxycarbonyl-4-(8-oxonioquinolin-2-yl)but-1-en-1-olate; palladium(2+); pyridine Traditional Name: 2-carbethoxy-1-ethoxy-4-(8-oxonio-2-quinolyl)but-1-en-1-olate; palladium(2+); pyridine Formula: C23H26N2O5Pd+2 MolecularWeight: 516.88294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(CCC1=NC2=C(C=CC=C2[OH2+])C=C1)C(=O)OCC)[O-].C1=CC=NC=C1.[Pd+2]

Isomeric SMILES

CCOC(=C(CCC1=NC2=C(C=CC=C2[OH2+])C=C1)C(=O)OCC)[O-].C1=CC=NC=C1.[Pd+2]

InChI

InChI=1S/C18H21NO5.C5H5N.Pd/c1-3-23-17(21)14(18(22)24-4-2)11-10-13-9-8-12-6-5-7-15(20)16(12)19-13;1-2-4-6-5-3-1;/h5-9,20-21H,3-4,10-11H2,1-2H3;1-5H;/q;;+2