2-[2-[(4-chlorophenyl)sulfonylamino]ethanoylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[2-[(4-chlorophenyl)sulfonylamino]ethanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[[2-[(4-chlorophenyl)sulfonylamino]acetyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-[(4-chlorophenyl)sulfonylamino]-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-[(4-chlorophenyl)sulfonylamino]acetyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-[(4-chlorophenyl)sulfonylamino]acetyl]amino]-3-methyl-butyric acid Formula: C13H17ClN2O5S MolecularWeight: 348.80248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)CNS(=O)(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)CNS(=O)(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H17ClN2O5S/c1-8(2)12(13(18)19)16-11(17)7-15-22(20,21)10-5-3-9(14)4-6-10/h3-6,8,12,15H,7H2,1-2H3,(H,16,17)(H,18,19)