2-[[6,7-bis(oxidanyl)-2-oxidanylidene-chromen-4-yl]methylsulfanyl]ethanoic acid

Systemtic Name: 2-[[6,7-bis(oxidanyl)-2-oxidanylidene-chromen-4-yl]methylsulfanyl]ethanoic acid Openeye Name: 2-[(6,7-dihydroxy-2-oxo-chromen-4-yl)methylsulfanyl]acetic acid CAS Name: 2-[(6,7-dihydroxy-2-oxo-1-benzopyran-4-yl)methylthio]acetic acid IUPAC Name: 2-[(6,7-dihydroxy-2-oxochromen-4-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(6,7-dihydroxy-2-keto-chromen-4-yl)methylthio]acetic acid Formula: C12H10O6S MolecularWeight: 282.2692

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C2=CC(=C(C=C2OC1=O)O)O)CSCC(=O)O

Isomeric SMILES

C1=C(C2=CC(=C(C=C2OC1=O)O)O)CSCC(=O)O

InChI

InChI=1S/C12H10O6S/c13-8-2-7-6(4-19-5-11(15)16)1-12(17)18-10(7)3-9(8)14/h1-3,13-14H,4-5H2,(H,15,16)