ethyl 4-(4-bromanyl-1-ethyl-pyrazol-3-yl)carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-(4-bromanyl-1-ethyl-pyrazol-3-yl)carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(4-bromo-1-ethyl-pyrazole-3-carbonyl)piperazine-1-carboxylate CAS Name: 4-[(4-bromo-1-ethyl-3-pyrazolyl)-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromo-1-ethylpyrazole-3-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(4-bromo-1-ethyl-pyrazole-3-carbonyl)piperazine-1-carboxylic acid ethyl ester Formula: C13H19BrN4O3 MolecularWeight: 359.21896

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)N2CCN(CC2)C(=O)OCC)Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)N2CCN(CC2)C(=O)OCC)Br

InChI

InChI=1S/C13H19BrN4O3/c1-3-18-9-10(14)11(15-18)12(19)16-5-7-17(8-6-16)13(20)21-4-2/h9H,3-8H2,1-2H3