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

Systemtic Name: 2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylamino]ethanoic acid Openeye Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]acetic acid CAS Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]acetic acid IUPAC Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]acetic acid Traditional Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]acetic acid Formula: C10H10BrNO4 MolecularWeight: 288.0947

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)CNCC(=O)O)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)CNCC(=O)O)Br

InChI

InChI=1S/C10H10BrNO4/c11-7-2-9-8(15-5-16-9)1-6(7)3-12-4-10(13)14/h1-2,12H,3-5H2,(H,13,14)