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

Systemtic Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-bromanyl-1-[(4-bromophenyl)methyl]pyrazole-3-carboxamide Openeye Name: N-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-4-bromo-1-[(4-bromophenyl)methyl]pyrazole-3-carboxamide CAS Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-bromo-1-[(4-bromophenyl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-bromo-1-[(4-bromophenyl)methyl]pyrazole-3-carboxamide Traditional Name: 4-bromo-1-(4-bromobenzyl)-N-[(E)-piperonylideneamino]pyrazole-3-carboxamide Formula: C19H14Br2N4O3 MolecularWeight: 506.14746

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=NNC(=O)C3=NN(C=C3Br)CC4=CC=C(C=C4)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=N/NC(=O)C3=NN(C=C3Br)CC4=CC=C(C=C4)Br

InChI

InChI=1S/C19H14Br2N4O3/c20-14-4-1-12(2-5-14)9-25-10-15(21)18(24-25)19(26)23-22-8-13-3-6-16-17(7-13)28-11-27-16/h1-8,10H,9,11H2,(H,23,26)/b22-8+