3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid

Systemtic Name: 3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid Openeye Name: 3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid CAS Name: 3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid IUPAC Name: 3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid Traditional Name: 3-[(2,4,5-trimethylphenyl)sulfonylamino]propionic acid Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)S(=O)(=O)NCCC(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1C)S(=O)(=O)NCCC(=O)O)C

InChI

InChI=1S/C12H17NO4S/c1-8-6-10(3)11(7-9(8)2)18(16,17)13-5-4-12(14)15/h6-7,13H,4-5H2,1-3H3,(H,14,15)