4-butyl-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-butyl-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-butyl-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-butyl-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-butyl-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-butyl-1-phenyl-pyrazolidine-3,5-quinone Formula: C26H32N4O4 MolecularWeight: 464.55668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=O)NN(C1=O)C2=CC=CC=C2.CCCCC1C(=O)NN(C1=O)C2=CC=CC=C2

Isomeric SMILES

CCCCC1C(=O)NN(C1=O)C2=CC=CC=C2.CCCCC1C(=O)NN(C1=O)C2=CC=CC=C2

InChI

InChI=1S/2C13H16N2O2/c2*1-2-3-9-11-12(16)14-15(13(11)17)10-7-5-4-6-8-10/h2*4-8,11H,2-3,9H2,1H3,(H,14,16)