1-butyl-5-(7-oxidanylidenecyclohepta-1,3,5-trien-1-yl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-butyl-5-(7-oxidanylidenecyclohepta-1,3,5-trien-1-yl)-1,3-diazinane-2,4,6-trione Openeye Name: 1-butyl-5-(7-oxocyclohepta-1,3,5-trien-1-yl)hexahydropyrimidine-2,4,6-trione CAS Name: 1-butyl-5-(7-oxo-1-cyclohepta-1,3,5-trienyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 1-butyl-5-(7-oxocyclohepta-1,3,5-trien-1-yl)-1,3-diazinane-2,4,6-trione Traditional Name: 1-butyl-5-(7-ketocyclohepta-1,3,5-trien-1-yl)barbituric acid Formula: C15H16N2O4 MolecularWeight: 288.29854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(C(=O)NC1=O)C2=CC=CC=CC2=O

Isomeric SMILES

CCCCN1C(=O)C(C(=O)NC1=O)C2=CC=CC=CC2=O

InChI

InChI=1S/C15H16N2O4/c1-2-3-9-17-14(20)12(13(19)16-15(17)21)10-7-5-4-6-8-11(10)18/h4-8,12H,2-3,9H2,1H3,(H,16,19,21)