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

Systemtic Name: N-[3-(4-bromanylpyrazol-1-yl)propyl]-4-[(2-methoxyphenoxy)methyl]benzamide Openeye Name: N-[3-(4-bromopyrazol-1-yl)propyl]-4-[(2-methoxyphenoxy)methyl]benzamide CAS Name: N-[3-(4-bromo-1-pyrazolyl)propyl]-4-[(2-methoxyphenoxy)methyl]benzamide IUPAC Name: N-[3-(4-bromopyrazol-1-yl)propyl]-4-[(2-methoxyphenoxy)methyl]benzamide Traditional Name: N-[3-(4-bromopyrazol-1-yl)propyl]-4-[(2-methoxyphenoxy)methyl]benzamide Formula: C21H22BrN3O3 MolecularWeight: 444.32168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCC2=CC=C(C=C2)C(=O)NCCCN3C=C(C=N3)Br

Isomeric SMILES

COC1=CC=CC=C1OCC2=CC=C(C=C2)C(=O)NCCCN3C=C(C=N3)Br

InChI

InChI=1S/C21H22BrN3O3/c1-27-19-5-2-3-6-20(19)28-15-16-7-9-17(10-8-16)21(26)23-11-4-12-25-14-18(22)13-24-25/h2-3,5-10,13-14H,4,11-12,15H2,1H3,(H,23,26)