2-[[1,3-bis(oxidanylidene)isoindol-2-yl]methylsulfanyl]propanoic acid

Systemtic Name: 2-[[1,3-bis(oxidanylidene)isoindol-2-yl]methylsulfanyl]propanoic acid Openeye Name: 2-[(1,3-dioxoisoindolin-2-yl)methylsulfanyl]propanoic acid CAS Name: 2-[(1,3-dioxo-2-isoindolyl)methylthio]propanoic acid IUPAC Name: 2-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]propanoic acid Traditional Name: 2-(phthalimidomethylthio)propionic acid Formula: C12H11NO4S MolecularWeight: 265.28504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCN1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CC(C(=O)O)SCN1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C12H11NO4S/c1-7(12(16)17)18-6-13-10(14)8-4-2-3-5-9(8)11(13)15/h2-5,7H,6H2,1H3,(H,16,17)