2-[2-(1,3-benzodioxol-4-yl)ethylamino]propanoic acid

Systemtic Name: 2-[2-(1,3-benzodioxol-4-yl)ethylamino]propanoic acid Openeye Name: 2-[2-(1,3-benzodioxol-4-yl)ethylamino]propanoic acid CAS Name: 2-[2-(1,3-benzodioxol-4-yl)ethylamino]propanoic acid IUPAC Name: 2-[2-(1,3-benzodioxol-4-yl)ethylamino]propanoic acid Traditional Name: 2-[2-(1,3-benzodioxol-4-yl)ethylamino]propionic acid Formula: C12H15NO4 MolecularWeight: 237.2518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NCCC1=C2C(=CC=C1)OCO2

Isomeric SMILES

CC(C(=O)O)NCCC1=C2C(=CC=C1)OCO2

InChI

InChI=1S/C12H15NO4/c1-8(12(14)15)13-6-5-9-3-2-4-10-11(9)17-7-16-10/h2-4,8,13H,5-7H2,1H3,(H,14,15)