(2S)-2-(7-chloranylquinolin-4-yl)sulfanylpropanoic acid

Systemtic Name: (2S)-2-(7-chloranylquinolin-4-yl)sulfanylpropanoic acid Openeye Name: (2S)-2-[(7-chloro-4-quinolyl)sulfanyl]propanoic acid CAS Name: (2S)-2-[(7-chloro-4-quinolinyl)thio]propanoic acid IUPAC Name: (2S)-2-(7-chloroquinolin-4-yl)sulfanylpropanoic acid Traditional Name: (2S)-2-[(7-chloro-4-quinolyl)thio]propionic acid Formula: C12H10ClNO2S MolecularWeight: 267.7313

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=C2C=CC(=CC2=NC=C1)Cl

Isomeric SMILES

C[C@@H](C(=O)O)SC1=C2C=CC(=CC2=NC=C1)Cl

InChI

InChI=1S/C12H10ClNO2S/c1-7(12(15)16)17-11-4-5-14-10-6-8(13)2-3-9(10)11/h2-7H,1H3,(H,15,16)/t7-/m0/s1