ethyl 5-aminocarbonyl-1-[2,4-bis(bromanyl)phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-aminocarbonyl-1-[2,4-bis(bromanyl)phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-carbamoyl-1-(2,4-dibromophenyl)pyrazole-4-carboxylate CAS Name: 5-carbamoyl-1-(2,4-dibromophenyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-carbamoyl-1-(2,4-dibromophenyl)pyrazole-4-carboxylate Traditional Name: 5-carbamoyl-1-(2,4-dibromophenyl)pyrazole-4-carboxylic acid ethyl ester Formula: C13H11Br2N3O3 MolecularWeight: 417.05274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=C(C=C(C=C2)Br)Br)C(=O)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=C(C=C(C=C2)Br)Br)C(=O)N

InChI

InChI=1S/C13H11Br2N3O3/c1-2-21-13(20)8-6-17-18(11(8)12(16)19)10-4-3-7(14)5-9(10)15/h3-6H,2H2,1H3,(H2,16,19)