3-[(5-methoxycarbonyl-2-methyl-phenyl)sulfonylamino]propanoic acid

Systemtic Name: 3-[(5-methoxycarbonyl-2-methyl-phenyl)sulfonylamino]propanoic acid Openeye Name: 3-[(5-methoxycarbonyl-2-methyl-phenyl)sulfonylamino]propanoic acid CAS Name: 3-[(5-methoxycarbonyl-2-methylphenyl)sulfonylamino]propanoic acid IUPAC Name: 3-[(5-methoxycarbonyl-2-methylphenyl)sulfonylamino]propanoic acid Traditional Name: 3-[(5-carbomethoxy-2-methyl-phenyl)sulfonylamino]propionic acid Formula: C12H15NO6S MolecularWeight: 301.3156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)NCCC(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)NCCC(=O)O

InChI

InChI=1S/C12H15NO6S/c1-8-3-4-9(12(16)19-2)7-10(8)20(17,18)13-6-5-11(14)15/h3-4,7,13H,5-6H2,1-2H3,(H,14,15)