2-[6-(2-azanylethyl)-1,3-benzodioxol-5-yl]ethanoic acid

Systemtic Name: 2-[6-(2-azanylethyl)-1,3-benzodioxol-5-yl]ethanoic acid Openeye Name: 2-[6-(2-aminoethyl)-1,3-benzodioxol-5-yl]acetic acid CAS Name: 2-[6-(2-aminoethyl)-1,3-benzodioxol-5-yl]acetic acid IUPAC Name: 2-[6-(2-aminoethyl)-1,3-benzodioxol-5-yl]acetic acid Traditional Name: 2-[6-(2-aminoethyl)-1,3-benzodioxol-5-yl]acetic acid Formula: C11H13NO4 MolecularWeight: 223.22522

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)CCN)CC(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)CCN)CC(=O)O

InChI

InChI=1S/C11H13NO4/c12-2-1-7-3-9-10(16-6-15-9)4-8(7)5-11(13)14/h3-4H,1-2,5-6,12H2,(H,13,14)