ethyl 2-(4-bromophenyl)-3-oxidanylidene-1H-1,2,4-triazole-5-carboxylate

Systemtic Name: ethyl 2-(4-bromophenyl)-3-oxidanylidene-1H-1,2,4-triazole-5-carboxylate Openeye Name: ethyl 2-(4-bromophenyl)-3-oxo-1H-1,2,4-triazole-5-carboxylate CAS Name: 2-(4-bromophenyl)-3-oxo-1H-1,2,4-triazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-bromophenyl)-3-oxo-1H-1,2,4-triazole-5-carboxylate Traditional Name: 2-(4-bromophenyl)-3-keto-1H-1,2,4-triazole-5-carboxylic acid ethyl ester Formula: C11H10BrN3O3 MolecularWeight: 312.1194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=O)N(N1)C2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)C1=NC(=O)N(N1)C2=CC=C(C=C2)Br

InChI

InChI=1S/C11H10BrN3O3/c1-2-18-10(16)9-13-11(17)15(14-9)8-5-3-7(12)4-6-8/h3-6H,2H2,1H3,(H,13,14,17)