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

Systemtic Name: 5-[[1-(3-nitrophenyl)pyrrol-3-yl]methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[1-(3-nitrophenyl)pyrrol-3-yl]methylene]-1-phenyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[1-(3-nitrophenyl)-3-pyrrolyl]methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[1-(3-nitrophenyl)pyrrol-3-yl]methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[[1-(3-nitrophenyl)pyrrol-3-yl]methylene]-1-phenyl-barbituric acid Formula: C21H14N4O5 MolecularWeight: 402.35966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H14N4O5/c26-19-18(20(27)24(21(28)22-19)15-5-2-1-3-6-15)11-14-9-10-23(13-14)16-7-4-8-17(12-16)25(29)30/h1-13H,(H,22,26,28)