1-(3-chlorophenyl)-5-[(3-ethoxy-5-nitro-4-oxidanyl-phenyl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(3-chlorophenyl)-5-[(3-ethoxy-5-nitro-4-oxidanyl-phenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-(3-chlorophenyl)-5-[(3-ethoxy-4-hydroxy-5-nitro-phenyl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(3-chlorophenyl)-5-[(3-ethoxy-4-hydroxy-5-nitrophenyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(3-chlorophenyl)-5-[(3-ethoxy-4-hydroxy-5-nitrophenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-(3-chlorophenyl)-5-(3-ethoxy-4-hydroxy-5-nitro-benzylidene)barbituric acid Formula: C19H14ClN3O7 MolecularWeight: 431.78336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])C=C2C(=O)NC(=O)N(C2=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])C=C2C(=O)NC(=O)N(C2=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H14ClN3O7/c1-2-30-15-8-10(7-14(16(15)24)23(28)29)6-13-17(25)21-19(27)22(18(13)26)12-5-3-4-11(20)9-12/h3-9,24H,2H2,1H3,(H,21,25,27)