6-[(4-methylphenyl)sulfonylamino]-4-oxidanylidene-hexanoic acid

Systemtic Name: 6-[(4-methylphenyl)sulfonylamino]-4-oxidanylidene-hexanoic acid Openeye Name: 4-oxo-6-(p-tolylsulfonylamino)hexanoic acid CAS Name: 6-[(4-methylphenyl)sulfonylamino]-4-oxohexanoic acid IUPAC Name: 6-[(4-methylphenyl)sulfonylamino]-4-oxohexanoic acid Traditional Name: 4-keto-6-(tosylamino)hexanoic acid Formula: C13H17NO5S MolecularWeight: 299.34278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)CCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)CCC(=O)O

InChI

InChI=1S/C13H17NO5S/c1-10-2-5-12(6-3-10)20(18,19)14-9-8-11(15)4-7-13(16)17/h2-3,5-6,14H,4,7-9H2,1H3,(H,16,17)