6-azanyl-2-[(4-methylphenyl)sulfonylamino]hexanoic acid; chloranylmethane

Systemtic Name: 6-azanyl-2-[(4-methylphenyl)sulfonylamino]hexanoic acid; chloranylmethane Openeye Name: 6-amino-2-(p-tolylsulfonylamino)hexanoic acid; chloromethane CAS Name: 6-amino-2-[(4-methylphenyl)sulfonylamino]hexanoic acid; chloromethane IUPAC Name: 6-amino-2-[(4-methylphenyl)sulfonylamino]hexanoic acid; chloromethane Traditional Name: 6-amino-2-(tosylamino)hexanoic acid; chloromethane Formula: C14H23ClN2O4S MolecularWeight: 350.86142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCCCN)C(=O)O.CCl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCCCN)C(=O)O.CCl

InChI

InChI=1S/C13H20N2O4S.CH3Cl/c1-10-5-7-11(8-6-10)20(18,19)15-12(13(16)17)4-2-3-9-14;1-2/h5-8,12,15H,2-4,9,14H2,1H3,(H,16,17);1H3