3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)propanoic acid

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)propanoic acid Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)propanoic acid CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)propanoic acid IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)propanoic acid Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)propionic acid Formula: C12H15NO4 MolecularWeight: 237.2518

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CNCCC(=O)O

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CNCCC(=O)O

InChI

InChI=1S/C12H15NO4/c14-12(15)3-4-13-8-9-1-2-10-11(7-9)17-6-5-16-10/h1-2,7,13H,3-6,8H2,(H,14,15)