1-(4-bromophenyl)-N-(3-ethanoylphenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide

Systemtic Name: 1-(4-bromophenyl)-N-(3-ethanoylphenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: N-(3-acetylphenyl)-1-(4-bromophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: N-(3-acetylphenyl)-1-(4-bromophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: N-(3-acetylphenyl)-1-(4-bromophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: N-(3-acetylphenyl)-1-(4-bromophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C22H20BrN3O2 MolecularWeight: 438.3171

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C2=NN(C3=C2CCCC3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)C2=NN(C3=C2CCCC3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H20BrN3O2/c1-14(27)15-5-4-6-17(13-15)24-22(28)21-19-7-2-3-8-20(19)26(25-21)18-11-9-16(23)10-12-18/h4-6,9-13H,2-3,7-8H2,1H3,(H,24,28)