2-[(2-chloranyl-5-nitro-pyrimidin-4-yl)amino]ethanoic acid

Systemtic Name: 2-[(2-chloranyl-5-nitro-pyrimidin-4-yl)amino]ethanoic acid Openeye Name: 2-[(2-chloro-5-nitro-pyrimidin-4-yl)amino]acetic acid CAS Name: 2-[(2-chloro-5-nitro-4-pyrimidinyl)amino]acetic acid IUPAC Name: 2-[(2-chloro-5-nitropyrimidin-4-yl)amino]acetic acid Traditional Name: 2-[(2-chloro-5-nitro-pyrimidin-4-yl)amino]acetic acid Formula: C6H5ClN4O4 MolecularWeight: 232.5813

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=NC(=N1)Cl)NCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=C(C(=NC(=N1)Cl)NCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C6H5ClN4O4/c7-6-9-1-3(11(14)15)5(10-6)8-2-4(12)13/h1H,2H2,(H,12,13)(H,8,9,10)