2-methyl-2-[(3-methylphenyl)sulfonylamino]pentanoic acid

Systemtic Name: 2-methyl-2-[(3-methylphenyl)sulfonylamino]pentanoic acid Openeye Name: 2-methyl-2-(m-tolylsulfonylamino)pentanoic acid CAS Name: 2-methyl-2-[(3-methylphenyl)sulfonylamino]pentanoic acid IUPAC Name: 2-methyl-2-[(3-methylphenyl)sulfonylamino]pentanoic acid Traditional Name: 2-methyl-2-(m-tolylsulfonylamino)valeric acid Formula: C13H19NO4S MolecularWeight: 285.35926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19NO4S/c1-4-8-13(3,12(15)16)14-19(17,18)11-7-5-6-10(2)9-11/h5-7,9,14H,4,8H2,1-3H3,(H,15,16)