2-(1,3-benzodioxol-5-yl)-2-(ethylamino)propanoic acid

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-2-(ethylamino)propanoic acid Openeye Name: 2-(1,3-benzodioxol-5-yl)-2-(ethylamino)propanoic acid CAS Name: 2-(1,3-benzodioxol-5-yl)-2-(ethylamino)propanoic acid IUPAC Name: 2-(1,3-benzodioxol-5-yl)-2-(ethylamino)propanoic acid Traditional Name: 2-(1,3-benzodioxol-5-yl)-2-(ethylamino)propionic acid Formula: C12H15NO4 MolecularWeight: 237.2518

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(C)(C1=CC2=C(C=C1)OCO2)C(=O)O

Isomeric SMILES

CCNC(C)(C1=CC2=C(C=C1)OCO2)C(=O)O

InChI

InChI=1S/C12H15NO4/c1-3-13-12(2,11(14)15)8-4-5-9-10(6-8)17-7-16-9/h4-6,13H,3,7H2,1-2H3,(H,14,15)