4-[(4-bromanylpyrazol-1-yl)methyl]-N-[(3,4-dimethoxyphenyl)methyl]benzamide

Systemtic Name: 4-[(4-bromanylpyrazol-1-yl)methyl]-N-[(3,4-dimethoxyphenyl)methyl]benzamide Openeye Name: 4-[(4-bromopyrazol-1-yl)methyl]-N-[(3,4-dimethoxyphenyl)methyl]benzamide CAS Name: 4-[(4-bromo-1-pyrazolyl)methyl]-N-[(3,4-dimethoxyphenyl)methyl]benzamide IUPAC Name: 4-[(4-bromopyrazol-1-yl)methyl]-N-[(3,4-dimethoxyphenyl)methyl]benzamide Traditional Name: 4-[(4-bromopyrazol-1-yl)methyl]-N-veratryl-benzamide Formula: C20H20BrN3O3 MolecularWeight: 430.2951

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=CC=C(C=C2)CN3C=C(C=N3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=CC=C(C=C2)CN3C=C(C=N3)Br)OC

InChI

InChI=1S/C20H20BrN3O3/c1-26-18-8-5-15(9-19(18)27-2)10-22-20(25)16-6-3-14(4-7-16)12-24-13-17(21)11-23-24/h3-9,11,13H,10,12H2,1-2H3,(H,22,25)