1-[2-(2,1,3-benzoxadiazol-5-ylcarbonyl)pyrazolidin-1-yl]pent-4-yn-1-one

Systemtic Name: 1-[2-(2,1,3-benzoxadiazol-5-ylcarbonyl)pyrazolidin-1-yl]pent-4-yn-1-one Openeye Name: 1-[2-(2,1,3-benzoxadiazole-5-carbonyl)pyrazolidin-1-yl]pent-4-yn-1-one CAS Name: 1-[2-[2,1,3-benzoxadiazol-5-yl(oxo)methyl]-1-pyrazolidinyl]-4-pentyn-1-one IUPAC Name: 1-[2-(2,1,3-benzoxadiazole-5-carbonyl)pyrazolidin-1-yl]pent-4-yn-1-one Traditional Name: 1-[2-(benzofurazan-5-carbonyl)pyrazolidin-1-yl]pent-4-yn-1-one Formula: C15H14N4O3 MolecularWeight: 298.29666

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCC(=O)N1CCCN1C(=O)C2=CC3=NON=C3C=C2

Isomeric SMILES

C#CCCC(=O)N1CCCN1C(=O)C2=CC3=NON=C3C=C2

InChI

InChI=1S/C15H14N4O3/c1-2-3-5-14(20)18-8-4-9-19(18)15(21)11-6-7-12-13(10-11)17-22-16-12/h1,6-7,10H,3-5,8-9H2