1-butyl-3-phenyl-pyrrole-2,5-dione

Systemtic Name: 1-butyl-3-phenyl-pyrrole-2,5-dione Openeye Name: 1-butyl-3-phenyl-pyrrole-2,5-dione CAS Name: 1-butyl-3-phenylpyrrole-2,5-dione IUPAC Name: 1-butyl-3-phenylpyrrole-2,5-dione Traditional Name: 1-butyl-3-phenyl-3-pyrroline-2,5-quinone Formula: C14H15NO2 MolecularWeight: 229.2744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C=C(C1=O)C2=CC=CC=C2

Isomeric SMILES

CCCCN1C(=O)C=C(C1=O)C2=CC=CC=C2

InChI

InChI=1S/C14H15NO2/c1-2-3-9-15-13(16)10-12(14(15)17)11-7-5-4-6-8-11/h4-8,10H,2-3,9H2,1H3