1-(4-bromophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate

Systemtic Name: 1-(4-bromophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate Openeye Name: 1-(4-bromophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate CAS Name: 1-(4-bromophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate IUPAC Name: 1-(4-bromophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate Traditional Name: 1-(4-bromophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate Formula: C14H12BrN2O2- MolecularWeight: 320.16128

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=NN2C3=CC=C(C=C3)Br)C(=O)[O-]

Isomeric SMILES

C1CCC2=C(C1)C(=NN2C3=CC=C(C=C3)Br)C(=O)[O-]

InChI

InChI=1S/C14H13BrN2O2/c15-9-5-7-10(8-6-9)17-12-4-2-1-3-11(12)13(16-17)14(18)19/h5-8H,1-4H2,(H,18,19)/p-1