2-(5-nitro-6-oxidanylidene-pyrimidin-1-yl)-2-phenyl-ethanoic acid

Systemtic Name: 2-(5-nitro-6-oxidanylidene-pyrimidin-1-yl)-2-phenyl-ethanoic acid Openeye Name: 2-(5-nitro-6-oxo-pyrimidin-1-yl)-2-phenyl-acetic acid CAS Name: 2-(5-nitro-6-oxo-1-pyrimidinyl)-2-phenylacetic acid IUPAC Name: 2-(5-nitro-6-oxopyrimidin-1-yl)-2-phenylacetic acid Traditional Name: 2-(6-keto-5-nitro-pyrimidin-1-yl)-2-phenyl-acetic acid Formula: C12H9N3O5 MolecularWeight: 275.21696

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)O)N2C=NC=C(C2=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)O)N2C=NC=C(C2=O)[N+](=O)[O-]

InChI

InChI=1S/C12H9N3O5/c16-11-9(15(19)20)6-13-7-14(11)10(12(17)18)8-4-2-1-3-5-8/h1-7,10H,(H,17,18)