3-[methyl-(4-methylphenyl)sulfonyl-amino]propanoate

Systemtic Name: 3-[methyl-(4-methylphenyl)sulfonyl-amino]propanoate Openeye Name: 3-[methyl(p-tolylsulfonyl)amino]propanoate CAS Name: 3-[methyl-(4-methylphenyl)sulfonylamino]propanoate IUPAC Name: 3-[methyl-(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 3-[methyl(tosyl)amino]propionate Formula: C11H14NO4S- MolecularWeight: 256.29816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)CCC(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)CCC(=O)[O-]

InChI

InChI=1S/C11H15NO4S/c1-9-3-5-10(6-4-9)17(15,16)12(2)8-7-11(13)14/h3-6H,7-8H2,1-2H3,(H,13,14)/p-1