3-[(3-acetamido-4-methoxy-phenyl)sulfonylamino]propanoic acid

Systemtic Name: 3-[(3-acetamido-4-methoxy-phenyl)sulfonylamino]propanoic acid Openeye Name: 3-[(3-acetamido-4-methoxy-phenyl)sulfonylamino]propanoic acid CAS Name: 3-[(3-acetamido-4-methoxyphenyl)sulfonylamino]propanoic acid IUPAC Name: 3-[(3-acetamido-4-methoxyphenyl)sulfonylamino]propanoic acid Traditional Name: 3-[(3-acetamido-4-methoxy-phenyl)sulfonylamino]propionic acid Formula: C12H16N2O6S MolecularWeight: 316.33024

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)NCCC(=O)O)OC

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)NCCC(=O)O)OC

InChI

InChI=1S/C12H16N2O6S/c1-8(15)14-10-7-9(3-4-11(10)20-2)21(18,19)13-6-5-12(16)17/h3-4,7,13H,5-6H2,1-2H3,(H,14,15)(H,16,17)