3-[(2,5-dimethyl-4-nitro-pyrazol-3-yl)amino]propanoic acid

Systemtic Name: 3-[(2,5-dimethyl-4-nitro-pyrazol-3-yl)amino]propanoic acid Openeye Name: 3-[(2,5-dimethyl-4-nitro-pyrazol-3-yl)amino]propanoic acid CAS Name: 3-[(2,5-dimethyl-4-nitro-3-pyrazolyl)amino]propanoic acid IUPAC Name: 3-[(2,5-dimethyl-4-nitropyrazol-3-yl)amino]propanoic acid Traditional Name: 3-[(2,5-dimethyl-4-nitro-pyrazol-3-yl)amino]propionic acid Formula: C8H12N4O4 MolecularWeight: 228.20528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])NCCC(=O)O)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])NCCC(=O)O)C

InChI

InChI=1S/C8H12N4O4/c1-5-7(12(15)16)8(11(2)10-5)9-4-3-6(13)14/h9H,3-4H2,1-2H3,(H,13,14)