(2S)-2-[[4-chloranyl-3-(dimethylsulfamoyl)phenyl]carbonylamino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[[4-chloranyl-3-(dimethylsulfamoyl)phenyl]carbonylamino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[[4-chloro-3-(dimethylsulfamoyl)benzoyl]amino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[[4-chloro-3-(dimethylsulfamoyl)phenyl]-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[[4-chloro-3-(dimethylsulfamoyl)benzoyl]amino]-3-methylbutanoic acid Traditional Name: (2S)-2-[[4-chloro-3-(dimethylsulfamoyl)benzoyl]amino]-3-methyl-butyric acid Formula: C14H19ClN2O5S MolecularWeight: 362.82906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N(C)C

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N(C)C

InChI

InChI=1S/C14H19ClN2O5S/c1-8(2)12(14(19)20)16-13(18)9-5-6-10(15)11(7-9)23(21,22)17(3)4/h5-8,12H,1-4H3,(H,16,18)(H,19,20)/t12-/m0/s1