3-[(4-ethoxy-3-methyl-phenyl)sulfonylamino]propanoic acid

Systemtic Name: 3-[(4-ethoxy-3-methyl-phenyl)sulfonylamino]propanoic acid Openeye Name: 3-[(4-ethoxy-3-methyl-phenyl)sulfonylamino]propanoic acid CAS Name: 3-[(4-ethoxy-3-methylphenyl)sulfonylamino]propanoic acid IUPAC Name: 3-[(4-ethoxy-3-methylphenyl)sulfonylamino]propanoic acid Traditional Name: 3-[(4-ethoxy-3-methyl-phenyl)sulfonylamino]propionic acid Formula: C12H17NO5S MolecularWeight: 287.33208

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)O)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)O)C

InChI

InChI=1S/C12H17NO5S/c1-3-18-11-5-4-10(8-9(11)2)19(16,17)13-7-6-12(14)15/h4-5,8,13H,3,6-7H2,1-2H3,(H,14,15)