5-[[4-(4-methoxyphenoxy)-3-nitro-phenyl]methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[[4-(4-methoxyphenoxy)-3-nitro-phenyl]methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[4-(4-methoxyphenoxy)-3-nitro-phenyl]methylene]-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[4-(4-methoxyphenoxy)-3-nitrophenyl]methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[4-(4-methoxyphenoxy)-3-nitrophenyl]methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[4-(4-methoxyphenoxy)-3-nitro-benzylidene]-1,3-dimethyl-barbituric acid Formula: C20H17N3O7 MolecularWeight: 411.36488

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC(=C(C=C2)OC3=CC=C(C=C3)OC)[N+](=O)[O-])C(=O)N(C1=O)C

Isomeric SMILES

CN1C(=O)C(=CC2=CC(=C(C=C2)OC3=CC=C(C=C3)OC)[N+](=O)[O-])C(=O)N(C1=O)C

InChI

InChI=1S/C20H17N3O7/c1-21-18(24)15(19(25)22(2)20(21)26)10-12-4-9-17(16(11-12)23(27)28)30-14-7-5-13(29-3)6-8-14/h4-11H,1-3H3