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

Systemtic Name: N-[3-(4-bromanylpyrazol-1-yl)propyl]-3-[(4-ethoxyphenoxy)methyl]benzamide Openeye Name: N-[3-(4-bromopyrazol-1-yl)propyl]-3-[(4-ethoxyphenoxy)methyl]benzamide CAS Name: N-[3-(4-bromo-1-pyrazolyl)propyl]-3-[(4-ethoxyphenoxy)methyl]benzamide IUPAC Name: N-[3-(4-bromopyrazol-1-yl)propyl]-3-[(4-ethoxyphenoxy)methyl]benzamide Traditional Name: N-[3-(4-bromopyrazol-1-yl)propyl]-3-[(4-ethoxyphenoxy)methyl]benzamide Formula: C22H24BrN3O3 MolecularWeight: 458.34826

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)NCCCN3C=C(C=N3)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)NCCCN3C=C(C=N3)Br

InChI

InChI=1S/C22H24BrN3O3/c1-2-28-20-7-9-21(10-8-20)29-16-17-5-3-6-18(13-17)22(27)24-11-4-12-26-15-19(23)14-25-26/h3,5-10,13-15H,2,4,11-12,16H2,1H3,(H,24,27)