2-[2-(2-methylpropyl)-3-oxidanylidene-1H-isoindol-1-yl]ethanoic acid

Systemtic Name: 2-[2-(2-methylpropyl)-3-oxidanylidene-1H-isoindol-1-yl]ethanoic acid Openeye Name: 2-(2-isobutyl-3-oxo-isoindolin-1-yl)acetic acid CAS Name: 2-[2-(2-methylpropyl)-3-oxo-1H-isoindol-1-yl]acetic acid IUPAC Name: 2-[2-(2-methylpropyl)-3-oxo-1H-isoindol-1-yl]acetic acid Traditional Name: 2-(2-isobutyl-3-keto-isoindolin-1-yl)acetic acid Formula: C14H17NO3 MolecularWeight: 247.28968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(C2=CC=CC=C2C1=O)CC(=O)O

Isomeric SMILES

CC(C)CN1C(C2=CC=CC=C2C1=O)CC(=O)O

InChI

InChI=1S/C14H17NO3/c1-9(2)8-15-12(7-13(16)17)10-5-3-4-6-11(10)14(15)18/h3-6,9,12H,7-8H2,1-2H3,(H,16,17)