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

Systemtic Name: 1-(furan-2-ylmethyl)-5-[[(2-methoxy-5-nitro-phenyl)amino]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-(2-furylmethyl)-5-[(2-methoxy-5-nitro-anilino)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(2-furanylmethyl)-5-[(2-methoxy-5-nitroanilino)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(furan-2-ylmethyl)-5-[(2-methoxy-5-nitroanilino)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-(2-furfuryl)-5-[(2-methoxy-5-nitro-anilino)methylene]barbituric acid Formula: C17H14N4O7 MolecularWeight: 386.31566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC=C2C(=O)NC(=O)N(C2=O)CC3=CC=CO3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC=C2C(=O)NC(=O)N(C2=O)CC3=CC=CO3

InChI

InChI=1S/C17H14N4O7/c1-27-14-5-4-10(21(25)26)7-13(14)18-8-12-15(22)19-17(24)20(16(12)23)9-11-3-2-6-28-11/h2-8,18H,9H2,1H3,(H,19,22,24)