dimethyl 5-[[4,5-bis(bromanyl)-1H-pyrazol-3-yl]carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[4,5-bis(bromanyl)-1H-pyrazol-3-yl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(4,5-dibromo-1H-pyrazole-3-carbonyl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[[(4,5-dibromo-1H-pyrazol-3-yl)-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(4,5-dibromo-1H-pyrazole-3-carbonyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(4,5-dibromo-1H-pyrazole-3-carbonyl)amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C14H11Br2N3O5 MolecularWeight: 461.06224

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=NNC(=C2Br)Br)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=NNC(=C2Br)Br)C(=O)OC

InChI

InChI=1S/C14H11Br2N3O5/c1-23-13(21)6-3-7(14(22)24-2)5-8(4-6)17-12(20)10-9(15)11(16)19-18-10/h3-5H,1-2H3,(H,17,20)(H,18,19)