[2,6-bis(chloranyl)-4-nitro-phenyl] 3-(4-bromophenyl)pyrazole-1-carboxylate

Systemtic Name: [2,6-bis(chloranyl)-4-nitro-phenyl] 3-(4-bromophenyl)pyrazole-1-carboxylate Openeye Name: (2,6-dichloro-4-nitro-phenyl) 3-(4-bromophenyl)pyrazole-1-carboxylate CAS Name: 3-(4-bromophenyl)-1-pyrazolecarboxylic acid (2,6-dichloro-4-nitrophenyl) ester IUPAC Name: (2,6-dichloro-4-nitrophenyl) 3-(4-bromophenyl)pyrazole-1-carboxylate Traditional Name: 3-(4-bromophenyl)pyrazole-1-carboxylic acid (2,6-dichloro-4-nitro-phenyl) ester Formula: C16H8BrCl2N3O4 MolecularWeight: 457.06242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN(C=C2)C(=O)OC3=C(C=C(C=C3Cl)[N+](=O)[O-])Cl)Br

Isomeric SMILES

C1=CC(=CC=C1C2=NN(C=C2)C(=O)OC3=C(C=C(C=C3Cl)[N+](=O)[O-])Cl)Br

InChI

InChI=1S/C16H8BrCl2N3O4/c17-10-3-1-9(2-4-10)14-5-6-21(20-14)16(23)26-15-12(18)7-11(22(24)25)8-13(15)19/h1-8H