3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanyl-propanoic acid

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanyl-propanoic acid Openeye Name: 3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxy-propanoic acid CAS Name: 3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropanoic acid IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropanoic acid Traditional Name: 3-(homoveratrylamino)-2-hydroxy-propionic acid Formula: C13H19NO5 MolecularWeight: 269.29366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCC(C(=O)O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCC(C(=O)O)O)OC

InChI

InChI=1S/C13H19NO5/c1-18-11-4-3-9(7-12(11)19-2)5-6-14-8-10(15)13(16)17/h3-4,7,10,14-15H,5-6,8H2,1-2H3,(H,16,17)