N-(4-bromanyl-2-methoxy-6-methyl-phenyl)-1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide

Systemtic Name: N-(4-bromanyl-2-methoxy-6-methyl-phenyl)-1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: N-(4-bromo-2-methoxy-6-methyl-phenyl)-1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: N-(4-bromo-2-methoxy-6-methylphenyl)-1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: N-(4-bromo-2-methoxy-6-methylphenyl)-1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: N-(4-bromo-2-methoxy-6-methyl-phenyl)-1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C22H21BrFN3O2 MolecularWeight: 458.323443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=O)C2=NN(C3=C2CCCC3)C4=CC=C(C=C4)F)OC)Br

Isomeric SMILES

CC1=CC(=CC(=C1NC(=O)C2=NN(C3=C2CCCC3)C4=CC=C(C=C4)F)OC)Br

InChI

InChI=1S/C22H21BrFN3O2/c1-13-11-14(23)12-19(29-2)20(13)25-22(28)21-17-5-3-4-6-18(17)27(26-21)16-9-7-15(24)8-10-16/h7-12H,3-6H2,1-2H3,(H,25,28)