N-(1,3-benzodioxol-5-ylmethyl)-2-(5-methyl-3-nitro-pyrazol-1-yl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(5-methyl-3-nitro-pyrazol-1-yl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(5-methyl-3-nitro-pyrazol-1-yl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(5-methyl-3-nitro-1-pyrazolyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(5-methyl-3-nitropyrazol-1-yl)acetamide Traditional Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-piperonyl-acetamide Formula: C14H14N4O5 MolecularWeight: 318.28476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(=O)NCC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CC(=O)NCC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

InChI

InChI=1S/C14H14N4O5/c1-9-4-13(18(20)21)16-17(9)7-14(19)15-6-10-2-3-11-12(5-10)23-8-22-11/h2-5H,6-8H2,1H3,(H,15,19)