3-[(3,5-dimethoxyphenyl)methylamino]propanoic acid

Systemtic Name: 3-[(3,5-dimethoxyphenyl)methylamino]propanoic acid Openeye Name: 3-[(3,5-dimethoxyphenyl)methylamino]propanoic acid CAS Name: 3-[(3,5-dimethoxyphenyl)methylamino]propanoic acid IUPAC Name: 3-[(3,5-dimethoxyphenyl)methylamino]propanoic acid Traditional Name: 3-[(3,5-dimethoxybenzyl)amino]propionic acid Formula: C12H17NO4 MolecularWeight: 239.26768

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CNCCC(=O)O)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CNCCC(=O)O)OC

InChI

InChI=1S/C12H17NO4/c1-16-10-5-9(6-11(7-10)17-2)8-13-4-3-12(14)15/h5-7,13H,3-4,8H2,1-2H3,(H,14,15)