(2S)-2-[[2,3-bis(chloranyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[[2,3-bis(chloranyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[(2,3-dichlorobenzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[(2,3-dichlorophenyl)-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[(2,3-dichlorobenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[(2,3-dichlorobenzoyl)amino]-4-(methylthio)butyrate Formula: C12H12Cl2NO3S- MolecularWeight: 321.19958

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])NC(=O)C1=C(C(=CC=C1)Cl)Cl

Isomeric SMILES

CSCC[C@@H](C(=O)[O-])NC(=O)C1=C(C(=CC=C1)Cl)Cl

InChI

InChI=1S/C12H13Cl2NO3S/c1-19-6-5-9(12(17)18)15-11(16)7-3-2-4-8(13)10(7)14/h2-4,9H,5-6H2,1H3,(H,15,16)(H,17,18)/p-1/t9-/m0/s1