5-(1,2,4-triazol-1-ylmethyl)-3H-2-benzofuran-1-one

Systemtic Name: 5-(1,2,4-triazol-1-ylmethyl)-3H-2-benzofuran-1-one Openeye Name: 5-(1,2,4-triazol-1-ylmethyl)-3H-isobenzofuran-1-one CAS Name: 5-(1,2,4-triazol-1-ylmethyl)-3H-isobenzofuran-1-one IUPAC Name: 5-(1,2,4-triazol-1-ylmethyl)-3H-2-benzofuran-1-one Traditional Name: 5-(1,2,4-triazol-1-ylmethyl)phthalide Formula: C11H9N3O2 MolecularWeight: 215.20806

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)CN3C=NC=N3)C(=O)O1

Isomeric SMILES

C1C2=C(C=CC(=C2)CN3C=NC=N3)C(=O)O1

InChI

InChI=1S/C11H9N3O2/c15-11-10-2-1-8(3-9(10)5-16-11)4-14-7-12-6-13-14/h1-3,6-7H,4-5H2