3-(1,3-benzodioxol-5-yl)-1-[2-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonylpyrazolidin-1-yl]propan-1-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonylpyrazolidin-1-yl]propan-1-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)pyrazolidin-1-yl]propan-1-one CAS Name: 3-(1,3-benzodioxol-5-yl)-1-[2-[(5-tert-butyl-2-methyl-3-pyrazolyl)-oxomethyl]-1-pyrazolidinyl]-1-propanone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(5-tert-butyl-2-methylpyrazole-3-carbonyl)pyrazolidin-1-yl]propan-1-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)pyrazolidin-1-yl]propan-1-one Formula: C22H28N4O4 MolecularWeight: 412.48212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)N2CCCN2C(=O)CCC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)N2CCCN2C(=O)CCC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C22H28N4O4/c1-22(2,3)19-13-16(24(4)23-19)21(28)26-11-5-10-25(26)20(27)9-7-15-6-8-17-18(12-15)30-14-29-17/h6,8,12-13H,5,7,9-11,14H2,1-4H3