3-[(4-bromanylphenoxy)methyl]-N-[1-(2-ethylpyrazol-3-yl)ethyl]benzamide

Systemtic Name: 3-[(4-bromanylphenoxy)methyl]-N-[1-(2-ethylpyrazol-3-yl)ethyl]benzamide Openeye Name: 3-[(4-bromophenoxy)methyl]-N-[1-(2-ethylpyrazol-3-yl)ethyl]benzamide CAS Name: 3-[(4-bromophenoxy)methyl]-N-[1-(2-ethyl-3-pyrazolyl)ethyl]benzamide IUPAC Name: 3-[(4-bromophenoxy)methyl]-N-[1-(2-ethylpyrazol-3-yl)ethyl]benzamide Traditional Name: 3-[(4-bromophenoxy)methyl]-N-[1-(2-ethylpyrazol-3-yl)ethyl]benzamide Formula: C21H22BrN3O2 MolecularWeight: 428.32228

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)C(C)NC(=O)C2=CC(=CC=C2)COC3=CC=C(C=C3)Br

Isomeric SMILES

CCN1C(=CC=N1)C(C)NC(=O)C2=CC(=CC=C2)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H22BrN3O2/c1-3-25-20(11-12-23-25)15(2)24-21(26)17-6-4-5-16(13-17)14-27-19-9-7-18(22)8-10-19/h4-13,15H,3,14H2,1-2H3,(H,24,26)