2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-ethanamide

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-ethanamide Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-acetamide CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-(5-spiro[1,3-benzodioxole-2,1'-cyclohexane]yl)acetamide IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-ylacetamide Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-acetamide Formula: C19H22N4O5 MolecularWeight: 386.40178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=CC3=C(C=C2)OC4(O3)CCCCC4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=CC3=C(C=C2)OC4(O3)CCCCC4)C)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O5/c1-12-18(23(25)26)13(2)22(21-12)11-17(24)20-14-6-7-15-16(10-14)28-19(27-15)8-4-3-5-9-19/h6-7,10H,3-5,8-9,11H2,1-2H3,(H,20,24)