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

Systemtic Name: (2S)-2-[(4-chloranyl-3-sulfamoyl-phenyl)carbonylamino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[(4-chloro-3-sulfamoyl-benzoyl)amino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[(4-chloro-3-sulfamoylphenyl)-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[(4-chloro-3-sulfamoylbenzoyl)amino]-3-methylbutanoic acid Traditional Name: (2S)-2-[(4-chloro-3-sulfamoyl-benzoyl)amino]-3-methyl-butyric acid Formula: C12H15ClN2O5S MolecularWeight: 334.7759

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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

Isomeric SMILES

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

InChI

InChI=1S/C12H15ClN2O5S/c1-6(2)10(12(17)18)15-11(16)7-3-4-8(13)9(5-7)21(14,19)20/h3-6,10H,1-2H3,(H,15,16)(H,17,18)(H2,14,19,20)/t10-/m0/s1