5-(3-oxidanylidenebutyl)-1-phenyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-(3-oxidanylidenebutyl)-1-phenyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-(3-oxobutyl)-1-phenyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-(3-oxobutyl)-1-phenyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(3-oxobutyl)-1-phenyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-(3-ketobutyl)-1-phenyl-barbituric acid Formula: C14H14N2O4 MolecularWeight: 274.27196

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1C(=O)NC(=O)N(C1=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)CCC1C(=O)NC(=O)N(C1=O)C2=CC=CC=C2

InChI

InChI=1S/C14H14N2O4/c1-9(17)7-8-11-12(18)15-14(20)16(13(11)19)10-5-3-2-4-6-10/h2-6,11H,7-8H2,1H3,(H,15,18,20)