N-(1,3-benzodioxol-5-yl)-4-[(4-bromanylpyrazol-1-yl)methyl]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-4-[(4-bromanylpyrazol-1-yl)methyl]benzamide Openeye Name: N-(1,3-benzodioxol-5-yl)-4-[(4-bromopyrazol-1-yl)methyl]benzamide CAS Name: N-(1,3-benzodioxol-5-yl)-4-[(4-bromo-1-pyrazolyl)methyl]benzamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-4-[(4-bromopyrazol-1-yl)methyl]benzamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-[(4-bromopyrazol-1-yl)methyl]benzamide Formula: C18H14BrN3O3 MolecularWeight: 400.22606

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)CN4C=C(C=N4)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)CN4C=C(C=N4)Br

InChI

InChI=1S/C18H14BrN3O3/c19-14-8-20-22(10-14)9-12-1-3-13(4-2-12)18(23)21-15-5-6-16-17(7-15)25-11-24-16/h1-8,10H,9,11H2,(H,21,23)