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

Systemtic Name: 2-(7-bromanyl-1,3-benzodioxol-5-yl)-2-(dimethylamino)ethanoic acid Openeye Name: 2-(7-bromo-1,3-benzodioxol-5-yl)-2-(dimethylamino)acetic acid CAS Name: 2-(7-bromo-1,3-benzodioxol-5-yl)-2-(dimethylamino)acetic acid IUPAC Name: 2-(7-bromo-1,3-benzodioxol-5-yl)-2-(dimethylamino)acetic acid Traditional Name: 2-(7-bromo-1,3-benzodioxol-5-yl)-2-(dimethylamino)acetic acid Formula: C11H12BrNO4 MolecularWeight: 302.12128

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(C1=CC2=C(C(=C1)Br)OCO2)C(=O)O

Isomeric SMILES

CN(C)C(C1=CC2=C(C(=C1)Br)OCO2)C(=O)O

InChI

InChI=1S/C11H12BrNO4/c1-13(2)9(11(14)15)6-3-7(12)10-8(4-6)16-5-17-10/h3-4,9H,5H2,1-2H3,(H,14,15)