3,3-dimethyl-2-(3-oxidanylidene-1H-isoindol-2-yl)butanoic acid

Systemtic Name: 3,3-dimethyl-2-(3-oxidanylidene-1H-isoindol-2-yl)butanoic acid Openeye Name: 3,3-dimethyl-2-(1-oxoisoindolin-2-yl)butanoic acid CAS Name: 3,3-dimethyl-2-(3-oxo-1H-isoindol-2-yl)butanoic acid IUPAC Name: 3,3-dimethyl-2-(3-oxo-1H-isoindol-2-yl)butanoic acid Traditional Name: 2-(1-ketoisoindolin-2-yl)-3,3-dimethyl-butyric acid Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)O)N1CC2=CC=CC=C2C1=O

Isomeric SMILES

CC(C)(C)C(C(=O)O)N1CC2=CC=CC=C2C1=O

InChI

InChI=1S/C14H17NO3/c1-14(2,3)11(13(17)18)15-8-9-6-4-5-7-10(9)12(15)16/h4-7,11H,8H2,1-3H3,(H,17,18)