2-[3-(carboxymethylsulfanyl)quinoxalin-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[3-(carboxymethylsulfanyl)quinoxalin-2-yl]sulfanylethanoic acid Openeye Name: 2-[3-(carboxymethylsulfanyl)quinoxalin-2-yl]sulfanylacetic acid CAS Name: 2-[[3-(carboxymethylthio)-2-quinoxalinyl]thio]acetic acid IUPAC Name: 2-[3-(carboxymethylsulfanyl)quinoxalin-2-yl]sulfanylacetic acid Traditional Name: 2-[[3-(carboxymethylthio)quinoxalin-2-yl]thio]acetic acid Formula: C12H10N2O4S2 MolecularWeight: 310.3488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(C(=N2)SCC(=O)O)SCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(C(=N2)SCC(=O)O)SCC(=O)O

InChI

InChI=1S/C12H10N2O4S2/c15-9(16)5-19-11-12(20-6-10(17)18)14-8-4-2-1-3-7(8)13-11/h1-4H,5-6H2,(H,15,16)(H,17,18)