3-[(2-bromanylphenoxy)methyl]-N-[3-(4-bromanylpyrazol-1-yl)propyl]benzamide

Systemtic Name: 3-[(2-bromanylphenoxy)methyl]-N-[3-(4-bromanylpyrazol-1-yl)propyl]benzamide Openeye Name: 3-[(2-bromophenoxy)methyl]-N-[3-(4-bromopyrazol-1-yl)propyl]benzamide CAS Name: 3-[(2-bromophenoxy)methyl]-N-[3-(4-bromo-1-pyrazolyl)propyl]benzamide IUPAC Name: 3-[(2-bromophenoxy)methyl]-N-[3-(4-bromopyrazol-1-yl)propyl]benzamide Traditional Name: 3-[(2-bromophenoxy)methyl]-N-[3-(4-bromopyrazol-1-yl)propyl]benzamide Formula: C20H19Br2N3O2 MolecularWeight: 493.19176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OCC2=CC=CC(=C2)C(=O)NCCCN3C=C(C=N3)Br)Br

Isomeric SMILES

C1=CC=C(C(=C1)OCC2=CC=CC(=C2)C(=O)NCCCN3C=C(C=N3)Br)Br

InChI

InChI=1S/C20H19Br2N3O2/c21-17-12-24-25(13-17)10-4-9-23-20(26)16-6-3-5-15(11-16)14-27-19-8-2-1-7-18(19)22/h1-3,5-8,11-13H,4,9-10,14H2,(H,23,26)