3-[(4-bromanylphenoxy)methyl]-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]benzamide

Systemtic Name: 3-[(4-bromanylphenoxy)methyl]-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]benzamide Openeye Name: 3-[(4-bromophenoxy)methyl]-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]benzamide CAS Name: 3-[(4-bromophenoxy)methyl]-N-[3-(3,5-dimethyl-1-pyrazolyl)propyl]benzamide IUPAC Name: 3-[(4-bromophenoxy)methyl]-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]benzamide Traditional Name: 3-[(4-bromophenoxy)methyl]-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]benzamide Formula: C22H24BrN3O2 MolecularWeight: 442.34886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCCNC(=O)C2=CC(=CC=C2)COC3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=CC(=NN1CCCNC(=O)C2=CC(=CC=C2)COC3=CC=C(C=C3)Br)C

InChI

InChI=1S/C22H24BrN3O2/c1-16-13-17(2)26(25-16)12-4-11-24-22(27)19-6-3-5-18(14-19)15-28-21-9-7-20(23)8-10-21/h3,5-10,13-14H,4,11-12,15H2,1-2H3,(H,24,27)