5-[(4-octoxyphenyl)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(4-octoxyphenyl)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(4-octoxyphenyl)methylene]-1-phenyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(4-octoxyphenyl)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(4-octoxyphenyl)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-(4-octoxybenzylidene)-1-phenyl-barbituric acid Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=CC=C3

InChI

InChI=1S/C25H28N2O4/c1-2-3-4-5-6-10-17-31-21-15-13-19(14-16-21)18-22-23(28)26-25(30)27(24(22)29)20-11-8-7-9-12-20/h7-9,11-16,18H,2-6,10,17H2,1H3,(H,26,28,30)