2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanylethanoic acid Openeye Name: 2-[2-(2-furylmethylamino)-2-oxo-ethyl]sulfanylacetic acid CAS Name: 2-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]acetic acid IUPAC Name: 2-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanylacetic acid Traditional Name: 2-[[2-(2-furfurylamino)-2-keto-ethyl]thio]acetic acid Formula: C9H11NO4S MolecularWeight: 229.25294

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(=O)CSCC(=O)O

Isomeric SMILES

C1=COC(=C1)CNC(=O)CSCC(=O)O

InChI

InChI=1S/C9H11NO4S/c11-8(5-15-6-9(12)13)10-4-7-2-1-3-14-7/h1-3H,4-6H2,(H,10,11)(H,12,13)