2-(4-ethyl-3-oxidanylidene-quinoxalin-2-yl)sulfanylethanoic acid

Systemtic Name: 2-(4-ethyl-3-oxidanylidene-quinoxalin-2-yl)sulfanylethanoic acid Openeye Name: 2-(4-ethyl-3-oxo-quinoxalin-2-yl)sulfanylacetic acid CAS Name: 2-[(4-ethyl-3-oxo-2-quinoxalinyl)thio]acetic acid IUPAC Name: 2-(4-ethyl-3-oxoquinoxalin-2-yl)sulfanylacetic acid Traditional Name: 2-[(4-ethyl-3-keto-quinoxalin-2-yl)thio]acetic acid Formula: C12H12N2O3S MolecularWeight: 264.30028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C(C1=O)SCC(=O)O

Isomeric SMILES

CCN1C2=CC=CC=C2N=C(C1=O)SCC(=O)O

InChI

InChI=1S/C12H12N2O3S/c1-2-14-9-6-4-3-5-8(9)13-11(12(14)17)18-7-10(15)16/h3-6H,2,7H2,1H3,(H,15,16)