2-[(4-chloranyl-2-methyl-phenyl)sulfonylamino]-2-methyl-pentanoic acid

Systemtic Name: 2-[(4-chloranyl-2-methyl-phenyl)sulfonylamino]-2-methyl-pentanoic acid Openeye Name: 2-[(4-chloro-2-methyl-phenyl)sulfonylamino]-2-methyl-pentanoic acid CAS Name: 2-[(4-chloro-2-methylphenyl)sulfonylamino]-2-methylpentanoic acid IUPAC Name: 2-[(4-chloro-2-methylphenyl)sulfonylamino]-2-methylpentanoic acid Traditional Name: 2-[(4-chloro-2-methyl-phenyl)sulfonylamino]-2-methyl-valeric acid Formula: C13H18ClNO4S MolecularWeight: 319.80432

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(=O)O)NS(=O)(=O)C1=C(C=C(C=C1)Cl)C

Isomeric SMILES

CCCC(C)(C(=O)O)NS(=O)(=O)C1=C(C=C(C=C1)Cl)C

InChI

InChI=1S/C13H18ClNO4S/c1-4-7-13(3,12(16)17)15-20(18,19)11-6-5-10(14)8-9(11)2/h5-6,8,15H,4,7H2,1-3H3,(H,16,17)