N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)ethanamide

Systemtic Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)ethanamide Openeye Name: N-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)acetamide CAS Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(4-bromo-3,5-dimethyl-1-pyrazolyl)acetamide IUPAC Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(4-bromo-3,5-dimethylpyrazol-1-yl)acetamide Traditional Name: 2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-[(E)-piperonylideneamino]acetamide Formula: C15H15BrN4O3 MolecularWeight: 379.2086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NN=CC2=CC3=C(C=C2)OCO3)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC(=O)N/N=C/C2=CC3=C(C=C2)OCO3)C)Br

InChI

InChI=1S/C15H15BrN4O3/c1-9-15(16)10(2)20(19-9)7-14(21)18-17-6-11-3-4-12-13(5-11)23-8-22-12/h3-6H,7-8H2,1-2H3,(H,18,21)/b17-6+