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

Systemtic Name: 3-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propylsulfanyl]propanoic acid Openeye Name: 3-[3-(1,3-dioxoisoindolin-2-yl)propylsulfanyl]propanoic acid CAS Name: 3-[3-(1,3-dioxo-2-isoindolyl)propylthio]propanoic acid IUPAC Name: 3-[3-(1,3-dioxoisoindol-2-yl)propylsulfanyl]propanoic acid Traditional Name: 3-(3-phthalimidopropylthio)propionic acid Formula: C14H15NO4S MolecularWeight: 293.3382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCSCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCSCCC(=O)O

InChI

InChI=1S/C14H15NO4S/c16-12(17)6-9-20-8-3-7-15-13(18)10-4-1-2-5-11(10)14(15)19/h1-2,4-5H,3,6-9H2,(H,16,17)