(E)-4-[(4-bromanyl-1-methyl-pyrazol-3-yl)amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(4-bromanyl-1-methyl-pyrazol-3-yl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[(4-bromo-1-methyl-pyrazol-3-yl)amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[(4-bromo-1-methyl-3-pyrazolyl)amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[(4-bromo-1-methylpyrazol-3-yl)amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[(4-bromo-1-methyl-pyrazol-3-yl)amino]-4-keto-but-2-enoic acid Formula: C8H8BrN3O3 MolecularWeight: 274.07142

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)NC(=O)C=CC(=O)O)Br

Isomeric SMILES

CN1C=C(C(=N1)NC(=O)/C=C/C(=O)O)Br

InChI

InChI=1S/C8H8BrN3O3/c1-12-4-5(9)8(11-12)10-6(13)2-3-7(14)15/h2-4H,1H3,(H,14,15)(H,10,11,13)/b3-2+