2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethylsulfanyl]ethanoic acid

Systemtic Name: 2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethylsulfanyl]ethanoic acid Openeye Name: 2-[2-(1,3-dioxoisoindolin-2-yl)ethylsulfanyl]acetic acid CAS Name: 2-[2-(1,3-dioxo-2-isoindolyl)ethylthio]acetic acid IUPAC Name: 2-[2-(1,3-dioxoisoindol-2-yl)ethylsulfanyl]acetic acid Traditional Name: 2-(2-phthalimidoethylthio)acetic acid Formula: C12H11NO4S MolecularWeight: 265.28504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11NO4S/c14-10(15)7-18-6-5-13-11(16)8-3-1-2-4-9(8)12(13)17/h1-4H,5-7H2,(H,14,15)