5-(2-azanyl-3-methyl-2-oxidanyl-butanoyl)-3H-2-benzofuran-1-one

Systemtic Name: 5-(2-azanyl-3-methyl-2-oxidanyl-butanoyl)-3H-2-benzofuran-1-one Openeye Name: 5-(2-amino-2-hydroxy-3-methyl-butanoyl)-3H-isobenzofuran-1-one CAS Name: 5-(2-amino-2-hydroxy-3-methyl-1-oxobutyl)-3H-isobenzofuran-1-one IUPAC Name: 5-(2-amino-2-hydroxy-3-methylbutanoyl)-3H-2-benzofuran-1-one Traditional Name: 5-(2-amino-2-hydroxy-3-methyl-butanoyl)phthalide Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)C1=CC2=C(C=C1)C(=O)OC2)(N)O

Isomeric SMILES

CC(C)C(C(=O)C1=CC2=C(C=C1)C(=O)OC2)(N)O

InChI

InChI=1S/C13H15NO4/c1-7(2)13(14,17)11(15)8-3-4-10-9(5-8)6-18-12(10)16/h3-5,7,17H,6,14H2,1-2H3