1-(furan-2-ylmethyl)-5-[(3-nitro-4-phenylmethoxy-phenyl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(furan-2-ylmethyl)-5-[(3-nitro-4-phenylmethoxy-phenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(4-benzyloxy-3-nitro-phenyl)methylene]-1-(2-furylmethyl)hexahydropyrimidine-2,4,6-trione CAS Name: 1-(2-furanylmethyl)-5-[(3-nitro-4-phenylmethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(furan-2-ylmethyl)-5-[(3-nitro-4-phenylmethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-(4-benzoxy-3-nitro-benzylidene)-1-(2-furfuryl)barbituric acid Formula: C23H17N3O7 MolecularWeight: 447.39698

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=C3C(=O)NC(=O)N(C3=O)CC4=CC=CO4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=C3C(=O)NC(=O)N(C3=O)CC4=CC=CO4)[N+](=O)[O-]

InChI

InChI=1S/C23H17N3O7/c27-21-18(22(28)25(23(29)24-21)13-17-7-4-10-32-17)11-16-8-9-20(19(12-16)26(30)31)33-14-15-5-2-1-3-6-15/h1-12H,13-14H2,(H,24,27,29)