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

Systemtic Name: N-[3-(4-bromanylpyrazol-1-yl)propyl]-4-[(4-chloranylphenoxy)methyl]benzamide Openeye Name: N-[3-(4-bromopyrazol-1-yl)propyl]-4-[(4-chlorophenoxy)methyl]benzamide CAS Name: N-[3-(4-bromo-1-pyrazolyl)propyl]-4-[(4-chlorophenoxy)methyl]benzamide IUPAC Name: N-[3-(4-bromopyrazol-1-yl)propyl]-4-[(4-chlorophenoxy)methyl]benzamide Traditional Name: N-[3-(4-bromopyrazol-1-yl)propyl]-4-[(4-chlorophenoxy)methyl]benzamide Formula: C20H19BrClN3O2 MolecularWeight: 448.74076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC2=CC=C(C=C2)Cl)C(=O)NCCCN3C=C(C=N3)Br

Isomeric SMILES

C1=CC(=CC=C1COC2=CC=C(C=C2)Cl)C(=O)NCCCN3C=C(C=N3)Br

InChI

InChI=1S/C20H19BrClN3O2/c21-17-12-24-25(13-17)11-1-10-23-20(26)16-4-2-15(3-5-16)14-27-19-8-6-18(22)7-9-19/h2-9,12-13H,1,10-11,14H2,(H,23,26)