1-[[5,6-dimethoxy-1,3-bis(oxidanylidene)inden-2-ylidene]amino]urea hydrate

Systemtic Name: 1-[[5,6-dimethoxy-1,3-bis(oxidanylidene)inden-2-ylidene]amino]urea hydrate Openeye Name: [(5,6-dimethoxy-1,3-dioxo-indan-2-ylidene)amino]urea hydrate CAS Name: [(5,6-dimethoxy-1,3-dioxo-2-indenylidene)amino]urea hydrate IUPAC Name: [(5,6-dimethoxy-1,3-dioxoinden-2-ylidene)amino]urea hydrate Traditional Name: [(1,3-diketo-5,6-dimethoxy-indan-2-ylidene)amino]urea hydrate Formula: C12H13N3O6 MolecularWeight: 295.24812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)C(=NNC(=O)N)C2=O)OC.O

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)C(=NNC(=O)N)C2=O)OC.O

InChI

InChI=1S/C12H11N3O5.H2O/c1-19-7-3-5-6(4-8(7)20-2)11(17)9(10(5)16)14-15-12(13)18;/h3-4H,1-2H3,(H3,13,15,18);1H2