4-[1-(propan-2-ylsulfonylamino)propan-2-yl]benzoic acid

Systemtic Name: 4-[1-(propan-2-ylsulfonylamino)propan-2-yl]benzoic acid Openeye Name: 4-[2-(isopropylsulfonylamino)-1-methyl-ethyl]benzoic acid CAS Name: 4-[1-(propan-2-ylsulfonylamino)propan-2-yl]benzoic acid IUPAC Name: 4-[1-(propan-2-ylsulfonylamino)propan-2-yl]benzoic acid Traditional Name: 4-[2-(isopropylsulfonylamino)-1-methyl-ethyl]benzoic acid Formula: C13H19NO4S MolecularWeight: 285.35926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)NCC(C)C1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CC(C)S(=O)(=O)NCC(C)C1=CC=C(C=C1)C(=O)O

InChI

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