4-butyl-1-phenyl-pyrazolidine-3,5-dione; lead; 2-methylidenebutanedioate

Systemtic Name: 4-butyl-1-phenyl-pyrazolidine-3,5-dione; lead; 2-methylidenebutanedioate Openeye Name: 4-butyl-1-phenyl-pyrazolidine-3,5-dione; lead; 2-methylenebutanedioate CAS Name: 4-butyl-1-phenylpyrazolidine-3,5-dione; lead; 2-methylenebutanedioate IUPAC Name: 4-butyl-1-phenylpyrazolidine-3,5-dione; lead; 2-methylidenebutanedioate Traditional Name: 4-butyl-1-phenyl-pyrazolidine-3,5-quinone; itaconate; lead Formula: C18H20N2O6Pb-2 MolecularWeight: 567.5612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=O)NN(C1=O)C2=CC=CC=C2.C=C(CC(=O)[O-])C(=O)[O-].[Pb]

Isomeric SMILES

CCCCC1C(=O)NN(C1=O)C2=CC=CC=C2.C=C(CC(=O)[O-])C(=O)[O-].[Pb]

InChI

InChI=1S/C13H16N2O2.C5H6O4.Pb/c1-2-3-9-11-12(16)14-15(13(11)17)10-7-5-4-6-8-10;1-3(5(8)9)2-4(6)7;/h4-8,11H,2-3,9H2,1H3,(H,14,16);1-2H2,(H,6,7)(H,8,9);/p-2