(5E)-1-(4-methoxyphenyl)-5-[[1-(3-nitrophenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: (5E)-1-(4-methoxyphenyl)-5-[[1-(3-nitrophenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: (5E)-1-(4-methoxyphenyl)-5-[[1-(3-nitrophenyl)pyrrol-3-yl]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: (5E)-1-(4-methoxyphenyl)-5-[[1-(3-nitrophenyl)-3-pyrrolyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: (5E)-1-(4-methoxyphenyl)-5-[[1-(3-nitrophenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: (5E)-1-(4-methoxyphenyl)-5-[[1-(3-nitrophenyl)pyrrol-3-yl]methylene]barbituric acid Formula: C22H16N4O6 MolecularWeight: 432.38564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C(=CC3=CN(C=C3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)NC2=O

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)/C(=C/C3=CN(C=C3)C4=CC(=CC=C4)[N+](=O)[O-])/C(=O)NC2=O

InChI

InChI=1S/C22H16N4O6/c1-32-18-7-5-15(6-8-18)25-21(28)19(20(27)23-22(25)29)11-14-9-10-24(13-14)16-3-2-4-17(12-16)26(30)31/h2-13H,1H3,(H,23,27,29)/b19-11+