N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-2-(3,5-dimethyl-4-nitro-1-pyrazolyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetamide Traditional Name: N-cyclopentyl-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-piperonyl-acetamide Formula: C20H24N4O5 MolecularWeight: 400.42836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)N(CC2=CC3=C(C=C2)OCO3)C4CCCC4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)N(CC2=CC3=C(C=C2)OCO3)C4CCCC4)C)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O5/c1-13-20(24(26)27)14(2)23(21-13)11-19(25)22(16-5-3-4-6-16)10-15-7-8-17-18(9-15)29-12-28-17/h7-9,16H,3-6,10-12H2,1-2H3