2-(5-bromanyl-1-benzofuran-2-yl)-2-(diethylamino)propanoic acid

Systemtic Name: 2-(5-bromanyl-1-benzofuran-2-yl)-2-(diethylamino)propanoic acid Openeye Name: 2-(5-bromobenzofuran-2-yl)-2-(diethylamino)propanoic acid CAS Name: 2-(5-bromo-2-benzofuranyl)-2-(diethylamino)propanoic acid IUPAC Name: 2-(5-bromo-1-benzofuran-2-yl)-2-(diethylamino)propanoic acid Traditional Name: 2-(5-bromobenzofuran-2-yl)-2-(diethylamino)propionic acid Formula: C15H18BrNO3 MolecularWeight: 340.21232

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(C)(C1=CC2=C(O1)C=CC(=C2)Br)C(=O)O

Isomeric SMILES

CCN(CC)C(C)(C1=CC2=C(O1)C=CC(=C2)Br)C(=O)O

InChI

InChI=1S/C15H18BrNO3/c1-4-17(5-2)15(3,14(18)19)13-9-10-8-11(16)6-7-12(10)20-13/h6-9H,4-5H2,1-3H3,(H,18,19)