5-(2-oxidanylidene-1H-indol-3-ylidene)-1,3-diazinane-2,4,6-trione hydrate

Systemtic Name: 5-(2-oxidanylidene-1H-indol-3-ylidene)-1,3-diazinane-2,4,6-trione hydrate Openeye Name: 5-(2-oxoindolin-3-ylidene)hexahydropyrimidine-2,4,6-trione hydrate CAS Name: 5-(2-oxo-1H-indol-3-ylidene)-1,3-diazinane-2,4,6-trione hydrate IUPAC Name: 5-(2-oxo-1H-indol-3-ylidene)-1,3-diazinane-2,4,6-trione hydrate Traditional Name: 5-(2-ketoindolin-3-ylidene)barbituric acid hydrate Formula: C12H9N3O5 MolecularWeight: 275.21696

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C(=O)NC(=O)NC3=O)C(=O)N2.O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C(=O)NC(=O)NC3=O)C(=O)N2.O

InChI

InChI=1S/C12H7N3O4.H2O/c16-9-7(5-3-1-2-4-6(5)13-9)8-10(17)14-12(19)15-11(8)18;/h1-4H,(H,13,16)(H2,14,15,17,18,19);1H2