(2S)-2-(4-nitropyrazol-1-yl)propanoate

Systemtic Name: (2S)-2-(4-nitropyrazol-1-yl)propanoate Openeye Name: (2S)-2-(4-nitropyrazol-1-yl)propanoate CAS Name: (2S)-2-(4-nitro-1-pyrazolyl)propanoate IUPAC Name: (2S)-2-(4-nitropyrazol-1-yl)propanoate Traditional Name: (2S)-2-(4-nitropyrazol-1-yl)propionate Formula: C6H6N3O4- MolecularWeight: 184.12954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])N1C=C(C=N1)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)[O-])N1C=C(C=N1)[N+](=O)[O-]

InChI

InChI=1S/C6H7N3O4/c1-4(6(10)11)8-3-5(2-7-8)9(12)13/h2-4H,1H3,(H,10,11)/p-1/t4-/m0/s1