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

Systemtic Name: ethyl 4-[(4-bromanyl-1-ethyl-pyrazol-3-yl)carbonylamino]benzoate Openeye Name: ethyl 4-[(4-bromo-1-ethyl-pyrazole-3-carbonyl)amino]benzoate CAS Name: 4-[[(4-bromo-1-ethyl-3-pyrazolyl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-bromo-1-ethylpyrazole-3-carbonyl)amino]benzoate Traditional Name: 4-[(4-bromo-1-ethyl-pyrazole-3-carbonyl)amino]benzoic acid ethyl ester Formula: C15H16BrN3O3 MolecularWeight: 366.20984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16BrN3O3/c1-3-19-9-12(16)13(18-19)14(20)17-11-7-5-10(6-8-11)15(21)22-4-2/h5-9H,3-4H2,1-2H3,(H,17,20)