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

Systemtic Name: 5-azanyl-2-[(2S)-butan-2-yl]pyrazole-3-carboxylate Openeye Name: 5-amino-2-[(1S)-1-methylpropyl]pyrazole-3-carboxylate CAS Name: 5-amino-2-[(2S)-butan-2-yl]-3-pyrazolecarboxylate IUPAC Name: 5-amino-2-[(2S)-butan-2-yl]pyrazole-3-carboxylate Traditional Name: 5-amino-2-[(1S)-1-methylpropyl]pyrazole-3-carboxylate Formula: C8H12N3O2- MolecularWeight: 182.19978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H13N3O2/c1-3-5(2)11-6(8(12)13)4-7(9)10-11/h4-5H,3H2,1-2H3,(H2,9,10)(H,12,13)/p-1/t5-/m0/s1