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

Systemtic Name: 5-[(5-chloranyl-2-octoxy-phenyl)methylidene]-1-(4-hydroxyphenyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(5-chloro-2-octoxy-phenyl)methylene]-1-(4-hydroxyphenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(5-chloro-2-octoxyphenyl)methylidene]-1-(4-hydroxyphenyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(5-chloro-2-octoxyphenyl)methylidene]-1-(4-hydroxyphenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-(5-chloro-2-octoxy-benzylidene)-1-(4-hydroxyphenyl)barbituric acid Formula: C25H27ClN2O5 MolecularWeight: 470.94528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27ClN2O5/c1-2-3-4-5-6-7-14-33-22-13-8-18(26)15-17(22)16-21-23(30)27-25(32)28(24(21)31)19-9-11-20(29)12-10-19/h8-13,15-16,29H,2-7,14H2,1H3,(H,27,30,32)