1-[2-(2,1,3-benzoxadiazol-5-ylcarbonyl)pyrazolidin-1-yl]-2-(3,4,5-trimethoxyphenyl)ethanone

Systemtic Name: 1-[2-(2,1,3-benzoxadiazol-5-ylcarbonyl)pyrazolidin-1-yl]-2-(3,4,5-trimethoxyphenyl)ethanone Openeye Name: 1-[2-(2,1,3-benzoxadiazole-5-carbonyl)pyrazolidin-1-yl]-2-(3,4,5-trimethoxyphenyl)ethanone CAS Name: 1-[2-[2,1,3-benzoxadiazol-5-yl(oxo)methyl]-1-pyrazolidinyl]-2-(3,4,5-trimethoxyphenyl)ethanone IUPAC Name: 1-[2-(2,1,3-benzoxadiazole-5-carbonyl)pyrazolidin-1-yl]-2-(3,4,5-trimethoxyphenyl)ethanone Traditional Name: 1-[2-(benzofurazan-5-carbonyl)pyrazolidin-1-yl]-2-(3,4,5-trimethoxyphenyl)ethanone Formula: C21H22N4O6 MolecularWeight: 426.42258

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC(=O)N2CCCN2C(=O)C3=CC4=NON=C4C=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC(=O)N2CCCN2C(=O)C3=CC4=NON=C4C=C3

InChI

InChI=1S/C21H22N4O6/c1-28-17-9-13(10-18(29-2)20(17)30-3)11-19(26)24-7-4-8-25(24)21(27)14-5-6-15-16(12-14)23-31-22-15/h5-6,9-10,12H,4,7-8,11H2,1-3H3