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

Systemtic Name: ethyl 4-[(4-bromanyl-1-methyl-pyrazol-3-yl)carbonylamino]benzoate Openeye Name: ethyl 4-[(4-bromo-1-methyl-pyrazole-3-carbonyl)amino]benzoate CAS Name: 4-[[(4-bromo-1-methyl-3-pyrazolyl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-bromo-1-methylpyrazole-3-carbonyl)amino]benzoate Traditional Name: 4-[(4-bromo-1-methyl-pyrazole-3-carbonyl)amino]benzoic acid ethyl ester Formula: C14H14BrN3O3 MolecularWeight: 352.18326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=NN(C=C2Br)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=NN(C=C2Br)C

InChI

InChI=1S/C14H14BrN3O3/c1-3-21-14(20)9-4-6-10(7-5-9)16-13(19)12-11(15)8-18(2)17-12/h4-8H,3H2,1-2H3,(H,16,19)