7-[1,3-bis(oxidanylidene)isoindol-2-yl]-6-oxidanylidene-2-sulfanyl-heptanoic acid

Systemtic Name: 7-[1,3-bis(oxidanylidene)isoindol-2-yl]-6-oxidanylidene-2-sulfanyl-heptanoic acid Openeye Name: 7-(1,3-dioxoisoindolin-2-yl)-6-oxo-2-sulfanyl-heptanoic acid CAS Name: 7-(1,3-dioxo-2-isoindolyl)-2-mercapto-6-oxoheptanoic acid IUPAC Name: 7-(1,3-dioxoisoindol-2-yl)-6-oxo-2-sulfanylheptanoic acid Traditional Name: 6-keto-2-mercapto-7-phthalimido-enanthic acid Formula: C15H15NO5S MolecularWeight: 321.3483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CC(=O)CCCC(C(=O)O)S

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CC(=O)CCCC(C(=O)O)S

InChI

InChI=1S/C15H15NO5S/c17-9(4-3-7-12(22)15(20)21)8-16-13(18)10-5-1-2-6-11(10)14(16)19/h1-2,5-6,12,22H,3-4,7-8H2,(H,20,21)