(2S)-2-(3-chloranylquinoxalin-2-yl)sulfanylpropanoic acid

Systemtic Name: (2S)-2-(3-chloranylquinoxalin-2-yl)sulfanylpropanoic acid Openeye Name: (2S)-2-(3-chloroquinoxalin-2-yl)sulfanylpropanoic acid CAS Name: (2S)-2-[(3-chloro-2-quinoxalinyl)thio]propanoic acid IUPAC Name: (2S)-2-(3-chloroquinoxalin-2-yl)sulfanylpropanoic acid Traditional Name: (2S)-2-[(3-chloroquinoxalin-2-yl)thio]propionic acid Formula: C11H9ClN2O2S MolecularWeight: 268.71936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=NC2=CC=CC=C2N=C1Cl

Isomeric SMILES

C[C@@H](C(=O)O)SC1=NC2=CC=CC=C2N=C1Cl

InChI

InChI=1S/C11H9ClN2O2S/c1-6(11(15)16)17-10-9(12)13-7-4-2-3-5-8(7)14-10/h2-6H,1H3,(H,15,16)/t6-/m0/s1