3-[(3-methoxyphenyl)methyl-methylsulfonyl-amino]propanoic acid

Systemtic Name: 3-[(3-methoxyphenyl)methyl-methylsulfonyl-amino]propanoic acid Openeye Name: 3-[(3-methoxyphenyl)methyl-methylsulfonyl-amino]propanoic acid CAS Name: 3-[(3-methoxyphenyl)methyl-methylsulfonylamino]propanoic acid IUPAC Name: 3-[(3-methoxyphenyl)methyl-methylsulfonylamino]propanoic acid Traditional Name: 3-[m-anisyl(mesyl)amino]propionic acid Formula: C12H17NO5S MolecularWeight: 287.33208

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN(CCC(=O)O)S(=O)(=O)C

Isomeric SMILES

COC1=CC=CC(=C1)CN(CCC(=O)O)S(=O)(=O)C

InChI

InChI=1S/C12H17NO5S/c1-18-11-5-3-4-10(8-11)9-13(19(2,16)17)7-6-12(14)15/h3-5,8H,6-7,9H2,1-2H3,(H,14,15)