4-(1,3-benzoxazol-2-ylsulfanyloxy)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(1,3-benzoxazol-2-ylsulfanyloxy)-4-oxidanylidene-butanoic acid Openeye Name: 4-(1,3-benzoxazol-2-ylsulfanyloxy)-4-oxo-butanoic acid CAS Name: 4-(1,3-benzoxazol-2-ylthio)oxy-4-oxobutanoic acid IUPAC Name: 4-(1,3-benzoxazol-2-ylsulfanyloxy)-4-oxobutanoic acid Traditional Name: 4-(1,3-benzoxazol-2-ylthio)oxy-4-keto-butyric acid Formula: C11H9NO5S MolecularWeight: 267.25786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SOC(=O)CCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SOC(=O)CCC(=O)O

InChI

InChI=1S/C11H9NO5S/c13-9(14)5-6-10(15)17-18-11-12-7-3-1-2-4-8(7)16-11/h1-4H,5-6H2,(H,13,14)