1-(butan-2-ylamino)pyrazole-4-carboxylic acid

Systemtic Name: 1-(butan-2-ylamino)pyrazole-4-carboxylic acid Openeye Name: 1-(sec-butylamino)pyrazole-4-carboxylic acid CAS Name: 1-(butan-2-ylamino)-4-pyrazolecarboxylic acid IUPAC Name: 1-(butan-2-ylamino)pyrazole-4-carboxylic acid Traditional Name: 1-(sec-butylamino)pyrazole-4-carboxylic acid Formula: C8H13N3O2 MolecularWeight: 183.20772

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NN1C=C(C=N1)C(=O)O

Isomeric SMILES

CCC(C)NN1C=C(C=N1)C(=O)O

InChI

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