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

Systemtic Name: 5-[(2-butoxy-5-chloranyl-phenyl)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(2-butoxy-5-chloro-phenyl)methylene]-1-phenyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(2-butoxy-5-chlorophenyl)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(2-butoxy-5-chlorophenyl)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-(2-butoxy-5-chloro-benzylidene)-1-phenyl-barbituric acid Formula: C21H19ClN2O4 MolecularWeight: 398.83956

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)Cl)C=C2C(=O)NC(=O)N(C2=O)C3=CC=CC=C3

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)Cl)C=C2C(=O)NC(=O)N(C2=O)C3=CC=CC=C3

InChI

InChI=1S/C21H19ClN2O4/c1-2-3-11-28-18-10-9-15(22)12-14(18)13-17-19(25)23-21(27)24(20(17)26)16-7-5-4-6-8-16/h4-10,12-13H,2-3,11H2,1H3,(H,23,25,27)