4-methylsulfanyl-2-(3-oxidanylidene-1H-isoindol-2-yl)butanoic acid

Systemtic Name: 4-methylsulfanyl-2-(3-oxidanylidene-1H-isoindol-2-yl)butanoic acid Openeye Name: 4-methylsulfanyl-2-(1-oxoisoindolin-2-yl)butanoic acid CAS Name: 4-(methylthio)-2-(3-oxo-1H-isoindol-2-yl)butanoic acid IUPAC Name: 4-methylsulfanyl-2-(3-oxo-1H-isoindol-2-yl)butanoic acid Traditional Name: 2-(1-ketoisoindolin-2-yl)-4-(methylthio)butyric acid Formula: C13H15NO3S MolecularWeight: 265.3281

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO3S/c1-18-7-6-11(13(16)17)14-8-9-4-2-3-5-10(9)12(14)15/h2-5,11H,6-8H2,1H3,(H,16,17)