5-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-ethanoyl-2-sulfanyl-pentanoic acid

Systemtic Name: 5-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-ethanoyl-2-sulfanyl-pentanoic acid Openeye Name: 2-acetyl-5-(1,3-dioxoisoindolin-2-yl)-2-sulfanyl-pentanoic acid CAS Name: 2-acetyl-5-(1,3-dioxo-2-isoindolyl)-2-mercaptopentanoic acid IUPAC Name: 2-acetyl-5-(1,3-dioxoisoindol-2-yl)-2-sulfanylpentanoic acid Traditional Name: 2-acetyl-2-mercapto-5-phthalimido-valeric acid Formula: C15H15NO5S MolecularWeight: 321.3483

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCCN1C(=O)C2=CC=CC=C2C1=O)(C(=O)O)S

Isomeric SMILES

CC(=O)C(CCCN1C(=O)C2=CC=CC=C2C1=O)(C(=O)O)S

InChI

InChI=1S/C15H15NO5S/c1-9(17)15(22,14(20)21)7-4-8-16-12(18)10-5-2-3-6-11(10)13(16)19/h2-3,5-6,22H,4,7-8H2,1H3,(H,20,21)