[2-(3-bromophenyl)-2-oxidanylidene-ethyl] 1H-indazole-3-carboxylate

Systemtic Name: [2-(3-bromophenyl)-2-oxidanylidene-ethyl] 1H-indazole-3-carboxylate Openeye Name: [2-(3-bromophenyl)-2-oxo-ethyl] 1H-indazole-3-carboxylate CAS Name: 1H-indazole-3-carboxylic acid [2-(3-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-bromophenyl)-2-oxoethyl] 1H-indazole-3-carboxylate Traditional Name: 1H-indazole-3-carboxylic acid [2-(3-bromophenyl)-2-keto-ethyl] ester Formula: C16H11BrN2O3 MolecularWeight: 359.17414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN2)C(=O)OCC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN2)C(=O)OCC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C16H11BrN2O3/c17-11-5-3-4-10(8-11)14(20)9-22-16(21)15-12-6-1-2-7-13(12)18-19-15/h1-8H,9H2,(H,18,19)