N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-[(3,5-dimethylpyrazol-1-yl)methyl]benzamide

Systemtic Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-[(3,5-dimethylpyrazol-1-yl)methyl]benzamide Openeye Name: N-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-4-[(3,5-dimethylpyrazol-1-yl)methyl]benzamide CAS Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-[(3,5-dimethyl-1-pyrazolyl)methyl]benzamide IUPAC Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-[(3,5-dimethylpyrazol-1-yl)methyl]benzamide Traditional Name: 4-[(3,5-dimethylpyrazol-1-yl)methyl]-N-[(E)-piperonylideneamino]benzamide Formula: C21H20N4O3 MolecularWeight: 376.4085

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=CC=C(C=C2)C(=O)NN=CC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=CC(=NN1CC2=CC=C(C=C2)C(=O)N/N=C/C3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C21H20N4O3/c1-14-9-15(2)25(24-14)12-16-3-6-18(7-4-16)21(26)23-22-11-17-5-8-19-20(10-17)28-13-27-19/h3-11H,12-13H2,1-2H3,(H,23,26)/b22-11+