3-[(4-bromanyl-1-methyl-pyrazol-3-yl)carbonylamino]propanoate

Systemtic Name: 3-[(4-bromanyl-1-methyl-pyrazol-3-yl)carbonylamino]propanoate Openeye Name: 3-[(4-bromo-1-methyl-pyrazole-3-carbonyl)amino]propanoate CAS Name: 3-[[(4-bromo-1-methyl-3-pyrazolyl)-oxomethyl]amino]propanoate IUPAC Name: 3-[(4-bromo-1-methylpyrazole-3-carbonyl)amino]propanoate Traditional Name: 3-[(4-bromo-1-methyl-pyrazole-3-carbonyl)amino]propionate Formula: C8H9BrN3O3- MolecularWeight: 275.07936

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NCCC(=O)[O-])Br

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NCCC(=O)[O-])Br

InChI

InChI=1S/C8H10BrN3O3/c1-12-4-5(9)7(11-12)8(15)10-3-2-6(13)14/h4H,2-3H2,1H3,(H,10,15)(H,13,14)/p-1