4-(3-oxidanylidenebutyl)-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-(3-oxidanylidenebutyl)-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-(3-oxobutyl)-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-(3-oxobutyl)-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-(3-oxobutyl)-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-(3-ketobutyl)-1-phenyl-pyrazolidine-3,5-quinone Formula: C13H14N2O3 MolecularWeight: 246.26186

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1C(=O)NN(C1=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)CCC1C(=O)NN(C1=O)C2=CC=CC=C2

InChI

InChI=1S/C13H14N2O3/c1-9(16)7-8-11-12(17)14-15(13(11)18)10-5-3-2-4-6-10/h2-6,11H,7-8H2,1H3,(H,14,17)