2-oxidanylidene-4-pyridin-3-yl-5H-pyrimidine-5-carboxylic acid hydrate

Systemtic Name: 2-oxidanylidene-4-pyridin-3-yl-5H-pyrimidine-5-carboxylic acid hydrate Openeye Name: 2-oxo-4-(3-pyridyl)-5H-pyrimidine-5-carboxylic acid hydrate CAS Name: 2-oxo-4-(3-pyridinyl)-5H-pyrimidine-5-carboxylic acid hydrate IUPAC Name: 2-oxo-4-pyridin-3-yl-5H-pyrimidine-5-carboxylic acid hydrate Traditional Name: 2-keto-4-(3-pyridyl)-5H-pyrimidine-5-carboxylic acid hydrate Formula: C10H9N3O4 MolecularWeight: 235.19616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NC(=O)N=CC2C(=O)O.O

Isomeric SMILES

C1=CC(=CN=C1)C2=NC(=O)N=CC2C(=O)O.O

InChI

InChI=1S/C10H7N3O3.H2O/c14-9(15)7-5-12-10(16)13-8(7)6-2-1-3-11-4-6;/h1-5,7H,(H,14,15);1H2