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

Systemtic Name: 2-[2-(2-oxidanylidene-1,3-benzoxazol-3-yl)ethylsulfanyl]ethanoic acid Openeye Name: 2-[2-(2-oxo-1,3-benzoxazol-3-yl)ethylsulfanyl]acetic acid CAS Name: 2-[2-(2-oxo-1,3-benzoxazol-3-yl)ethylthio]acetic acid IUPAC Name: 2-[2-(2-oxo-1,3-benzoxazol-3-yl)ethylsulfanyl]acetic acid Traditional Name: 2-[2-(2-keto-1,3-benzoxazol-3-yl)ethylthio]acetic acid Formula: C11H11NO4S MolecularWeight: 253.27434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=O)O2)CCSCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=O)O2)CCSCC(=O)O

InChI

InChI=1S/C11H11NO4S/c13-10(14)7-17-6-5-12-8-3-1-2-4-9(8)16-11(12)15/h1-4H,5-7H2,(H,13,14)