3-[(2,5-dimethoxyphenyl)-methyl-amino]propanoic acid

Systemtic Name: 3-[(2,5-dimethoxyphenyl)-methyl-amino]propanoic acid Openeye Name: 3-(2,5-dimethoxy-N-methyl-anilino)propanoic acid CAS Name: 3-(2,5-dimethoxy-N-methylanilino)propanoic acid IUPAC Name: 3-(2,5-dimethoxy-N-methylanilino)propanoic acid Traditional Name: 3-(2,5-dimethoxy-N-methyl-anilino)propionic acid Formula: C12H17NO4 MolecularWeight: 239.26768

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=O)O)C1=C(C=CC(=C1)OC)OC

Isomeric SMILES

CN(CCC(=O)O)C1=C(C=CC(=C1)OC)OC

InChI

InChI=1S/C12H17NO4/c1-13(7-6-12(14)15)10-8-9(16-2)4-5-11(10)17-3/h4-5,8H,6-7H2,1-3H3,(H,14,15)