2-(5-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(diethylamino)ethanoic acid

Systemtic Name: 2-(5-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(diethylamino)ethanoic acid Openeye Name: 2-(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(diethylamino)acetic acid CAS Name: 2-(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(diethylamino)acetic acid IUPAC Name: 2-(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(diethylamino)acetic acid Traditional Name: 2-(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(diethylamino)acetic acid Formula: C14H18BrNO4 MolecularWeight: 344.20102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(C1=CC2=C(C(=C1)Br)OCCO2)C(=O)O

Isomeric SMILES

CCN(CC)C(C1=CC2=C(C(=C1)Br)OCCO2)C(=O)O

InChI

InChI=1S/C14H18BrNO4/c1-3-16(4-2)12(14(17)18)9-7-10(15)13-11(8-9)19-5-6-20-13/h7-8,12H,3-6H2,1-2H3,(H,17,18)