2-[(3-oxidanylidene-4H-quinoxalin-2-yl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(3-oxidanylidene-4H-quinoxalin-2-yl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(3-oxo-4H-quinoxalin-2-yl)methylsulfanyl]acetic acid CAS Name: 2-[(3-oxo-4H-quinoxalin-2-yl)methylthio]acetic acid IUPAC Name: 2-[(3-oxo-4H-quinoxalin-2-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(3-keto-4H-quinoxalin-2-yl)methylthio]acetic acid Formula: C11H10N2O3S MolecularWeight: 250.2737

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)C(=N2)CSCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)C(=N2)CSCC(=O)O

InChI

InChI=1S/C11H10N2O3S/c14-10(15)6-17-5-9-11(16)13-8-4-2-1-3-7(8)12-9/h1-4H,5-6H2,(H,13,16)(H,14,15)