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1-[(2S)-butan-2-yl]-5-nitro-pyrazole-3-carboxylate

1-[(2S)-butan-2-yl]-5-nitro-pyrazole-3-carboxylate

Systemtic Name:1-[(2S)-butan-2-yl]-5-nitro-pyrazole-3-carboxylate
Openeye Name:1-[(1S)-1-methylpropyl]-5-nitro-pyrazole-3-carboxylate
CAS Name:1-[(2S)-butan-2-yl]-5-nitro-3-pyrazolecarboxylate
IUPAC Name:1-[(2S)-butan-2-yl]-5-nitropyrazole-3-carboxylate
Traditional Name:1-[(1S)-1-methylpropyl]-5-nitro-pyrazole-3-carboxylate
Formula: C8H10N3O4-
MolecularWeight: 212.1827
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C8H11N3O4/c1-3-5(2)10-7(11(14)15)4-6(9-10)8(12)13/h4-5H,3H2,1-2H3,(H,12,13)/p-1/t5-/m0/s1


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