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

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-tert-butylsulfanyl-propanoic acid Openeye Name: 2-tert-butylsulfanyl-3-(1,3-dioxoisoindolin-2-yl)propanoic acid CAS Name: 2-(tert-butylthio)-3-(1,3-dioxo-2-isoindolyl)propanoic acid IUPAC Name: 2-tert-butylsulfanyl-3-(1,3-dioxoisoindol-2-yl)propanoic acid Traditional Name: 2-(tert-butylthio)-3-phthalimido-propionic acid Formula: C15H17NO4S MolecularWeight: 307.36478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17NO4S/c1-15(2,3)21-11(14(19)20)8-16-12(17)9-6-4-5-7-10(9)13(16)18/h4-7,11H,8H2,1-3H3,(H,19,20)