2-(1,3-benzodioxol-5-yl)-1-[2-(2,5-dimethyl-4-nitro-pyrazol-3-yl)carbonylpyrazolidin-1-yl]ethanone

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(2,5-dimethyl-4-nitro-pyrazol-3-yl)carbonylpyrazolidin-1-yl]ethanone Openeye Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(2,5-dimethyl-4-nitro-pyrazole-3-carbonyl)pyrazolidin-1-yl]ethanone CAS Name: 2-(1,3-benzodioxol-5-yl)-1-[2-[(2,5-dimethyl-4-nitro-3-pyrazolyl)-oxomethyl]-1-pyrazolidinyl]ethanone IUPAC Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(2,5-dimethyl-4-nitropyrazole-3-carbonyl)pyrazolidin-1-yl]ethanone Traditional Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(2,5-dimethyl-4-nitro-pyrazole-3-carbonyl)pyrazolidin-1-yl]ethanone Formula: C18H19N5O6 MolecularWeight: 401.37336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])C(=O)N2CCCN2C(=O)CC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])C(=O)N2CCCN2C(=O)CC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C18H19N5O6/c1-11-16(23(26)27)17(20(2)19-11)18(25)22-7-3-6-21(22)15(24)9-12-4-5-13-14(8-12)29-10-28-13/h4-5,8H,3,6-7,9-10H2,1-2H3