2-[2-oxidanylidene-2-[(3-oxidanylidene-1H-2-benzofuran-5-yl)amino]ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-oxidanylidene-2-[(3-oxidanylidene-1H-2-benzofuran-5-yl)amino]ethyl]sulfanylethanoic acid Openeye Name: 2-[2-oxo-2-[(3-oxo-1H-isobenzofuran-5-yl)amino]ethyl]sulfanylacetic acid CAS Name: 2-[[2-oxo-2-[(3-oxo-1H-isobenzofuran-5-yl)amino]ethyl]thio]acetic acid IUPAC Name: 2-[2-oxo-2-[(3-oxo-1H-2-benzofuran-5-yl)amino]ethyl]sulfanylacetic acid Traditional Name: 2-[[2-keto-2-[(3-ketophthalan-5-yl)amino]ethyl]thio]acetic acid Formula: C12H11NO5S MolecularWeight: 281.28444

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)NC(=O)CSCC(=O)O)C(=O)O1

Isomeric SMILES

C1C2=C(C=C(C=C2)NC(=O)CSCC(=O)O)C(=O)O1

InChI

InChI=1S/C12H11NO5S/c14-10(5-19-6-11(15)16)13-8-2-1-7-4-18-12(17)9(7)3-8/h1-3H,4-6H2,(H,13,14)(H,15,16)