N-[4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-(4-bromo-3,5-dimethyl-1-pyrazolyl)phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-(4-bromo-3,5-dimethylpyrazol-1-yl)phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)phenyl]-piperonylamide Formula: C19H16BrN3O3 MolecularWeight: 414.25264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCO4)C)Br

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCO4)C)Br

InChI

InChI=1S/C19H16BrN3O3/c1-11-18(20)12(2)23(22-11)15-6-4-14(5-7-15)21-19(24)13-3-8-16-17(9-13)26-10-25-16/h3-9H,10H2,1-2H3,(H,21,24)