1-(4-bromanyl-3-methyl-phenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate

Systemtic Name: 1-(4-bromanyl-3-methyl-phenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate Openeye Name: 1-(4-bromo-3-methyl-phenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate CAS Name: 1-(4-bromo-3-methylphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate IUPAC Name: 1-(4-bromo-3-methylphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate Traditional Name: 1-(4-bromo-3-methyl-phenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate Formula: C15H14BrN2O2- MolecularWeight: 334.18786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2C3=C(CCCC3)C(=N2)C(=O)[O-])Br

Isomeric SMILES

CC1=C(C=CC(=C1)N2C3=C(CCCC3)C(=N2)C(=O)[O-])Br

InChI

InChI=1S/C15H15BrN2O2/c1-9-8-10(6-7-12(9)16)18-13-5-3-2-4-11(13)14(17-18)15(19)20/h6-8H,2-5H2,1H3,(H,19,20)/p-1