(2R)-2-[(2-chloranyl-5-nitro-phenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2R)-2-[(2-chloranyl-5-nitro-phenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: (2R)-2-[(2-chloro-5-nitro-benzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[(2-chloro-5-nitrophenyl)-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2R)-2-[(2-chloro-5-nitrobenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[(2-chloro-5-nitro-benzoyl)amino]-4-(methylthio)butyrate Formula: C12H12ClN2O5S- MolecularWeight: 331.75208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13ClN2O5S/c1-21-5-4-10(12(17)18)14-11(16)8-6-7(15(19)20)2-3-9(8)13/h2-3,6,10H,4-5H2,1H3,(H,14,16)(H,17,18)/p-1/t10-/m1/s1