methyl 3-[(4-bromanyl-2-ethyl-pyrazol-3-yl)carbonylamino]benzoate

Systemtic Name: methyl 3-[(4-bromanyl-2-ethyl-pyrazol-3-yl)carbonylamino]benzoate Openeye Name: methyl 3-[(4-bromo-2-ethyl-pyrazole-3-carbonyl)amino]benzoate CAS Name: 3-[[(4-bromo-2-ethyl-3-pyrazolyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(4-bromo-2-ethylpyrazole-3-carbonyl)amino]benzoate Traditional Name: 3-[(4-bromo-2-ethyl-pyrazole-3-carbonyl)amino]benzoic acid methyl ester Formula: C14H14BrN3O3 MolecularWeight: 352.18326

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)Br)C(=O)NC2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

CCN1C(=C(C=N1)Br)C(=O)NC2=CC=CC(=C2)C(=O)OC

InChI

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