2-(4-bromanylphenoxy)-N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]ethanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]ethanamide Openeye Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-2-(4-bromophenoxy)acetamide CAS Name: 2-(4-bromophenoxy)-N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]acetamide IUPAC Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-2-(4-bromophenoxy)acetamide Traditional Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-2-(4-bromophenoxy)acetamide Formula: C22H22BrN3O2 MolecularWeight: 440.33298

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)N(N=C2)CC3=CC=CC=C3)NC(=O)COC4=CC=C(C=C4)Br

Isomeric SMILES

C1CC(C2=C(C1)N(N=C2)CC3=CC=CC=C3)NC(=O)COC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H22BrN3O2/c23-17-9-11-18(12-10-17)28-15-22(27)25-20-7-4-8-21-19(20)13-24-26(21)14-16-5-2-1-3-6-16/h1-3,5-6,9-13,20H,4,7-8,14-15H2,(H,25,27)