5-azanyl-1-(2-methylpropyl)pyrazole-3-carboxylic acid

Systemtic Name: 5-azanyl-1-(2-methylpropyl)pyrazole-3-carboxylic acid Openeye Name: 5-amino-1-isobutyl-pyrazole-3-carboxylic acid CAS Name: 5-amino-1-(2-methylpropyl)-3-pyrazolecarboxylic acid IUPAC Name: 5-amino-1-(2-methylpropyl)pyrazole-3-carboxylic acid Traditional Name: 5-amino-1-isobutyl-pyrazole-3-carboxylic acid Formula: C8H13N3O2 MolecularWeight: 183.20772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CC(=N1)C(=O)O)N

Isomeric SMILES

CC(C)CN1C(=CC(=N1)C(=O)O)N

InChI

InChI=1S/C8H13N3O2/c1-5(2)4-11-7(9)3-6(10-11)8(12)13/h3,5H,4,9H2,1-2H3,(H,12,13)