3,3-dimethyl-2-[(phenylmethyl)sulfonylamino]butanoic acid

Systemtic Name: 3,3-dimethyl-2-[(phenylmethyl)sulfonylamino]butanoic acid Openeye Name: 2-(benzylsulfonylamino)-3,3-dimethyl-butanoic acid CAS Name: 3,3-dimethyl-2-[(phenylmethyl)sulfonylamino]butanoic acid IUPAC Name: 2-(benzylsulfonylamino)-3,3-dimethylbutanoic acid Traditional Name: 2-(benzylsulfonylamino)-3,3-dimethyl-butyric acid Formula: C13H19NO4S MolecularWeight: 285.35926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)O)NS(=O)(=O)CC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)C(C(=O)O)NS(=O)(=O)CC1=CC=CC=C1

InChI

InChI=1S/C13H19NO4S/c1-13(2,3)11(12(15)16)14-19(17,18)9-10-7-5-4-6-8-10/h4-8,11,14H,9H2,1-3H3,(H,15,16)