N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-bromanyl-1H-pyrazole-5-carboxamide

Systemtic Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-bromanyl-1H-pyrazole-5-carboxamide Openeye Name: N-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-4-bromo-1H-pyrazole-5-carboxamide CAS Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-bromo-1H-pyrazole-5-carboxamide IUPAC Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-bromo-1H-pyrazole-5-carboxamide Traditional Name: 4-bromo-N-[(E)-piperonylideneamino]-1H-pyrazole-5-carboxamide Formula: C12H9BrN4O3 MolecularWeight: 337.12886

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=NNC(=O)C3=C(C=NN3)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=N/NC(=O)C3=C(C=NN3)Br

InChI

InChI=1S/C12H9BrN4O3/c13-8-5-15-16-11(8)12(18)17-14-4-7-1-2-9-10(3-7)20-6-19-9/h1-5H,6H2,(H,15,16)(H,17,18)/b14-4+