2-(7-bromanyl-1,3-benzodioxol-5-yl)-2-(cyclopropylamino)ethanoic acid

Systemtic Name: 2-(7-bromanyl-1,3-benzodioxol-5-yl)-2-(cyclopropylamino)ethanoic acid Openeye Name: 2-(7-bromo-1,3-benzodioxol-5-yl)-2-(cyclopropylamino)acetic acid CAS Name: 2-(7-bromo-1,3-benzodioxol-5-yl)-2-(cyclopropylamino)acetic acid IUPAC Name: 2-(7-bromo-1,3-benzodioxol-5-yl)-2-(cyclopropylamino)acetic acid Traditional Name: 2-(7-bromo-1,3-benzodioxol-5-yl)-2-(cyclopropylamino)acetic acid Formula: C12H12BrNO4 MolecularWeight: 314.13198

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(C2=CC3=C(C(=C2)Br)OCO3)C(=O)O

Isomeric SMILES

C1CC1NC(C2=CC3=C(C(=C2)Br)OCO3)C(=O)O

InChI

InChI=1S/C12H12BrNO4/c13-8-3-6(4-9-11(8)18-5-17-9)10(12(15)16)14-7-1-2-7/h3-4,7,10,14H,1-2,5H2,(H,15,16)