2-[(7-bromanyl-1,3-benzodioxol-5-yl)methylamino]ethanoic acid

Systemtic Name: 2-[(7-bromanyl-1,3-benzodioxol-5-yl)methylamino]ethanoic acid Openeye Name: 2-[(7-bromo-1,3-benzodioxol-5-yl)methylamino]acetic acid CAS Name: 2-[(7-bromo-1,3-benzodioxol-5-yl)methylamino]acetic acid IUPAC Name: 2-[(7-bromo-1,3-benzodioxol-5-yl)methylamino]acetic acid Traditional Name: 2-[(7-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(=CC(=C2)CNCC(=O)O)Br

Isomeric SMILES

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

InChI

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