4-azanyl-3-(5-methoxy-1-benzofuran-2-yl)butanoic acid

Systemtic Name: 4-azanyl-3-(5-methoxy-1-benzofuran-2-yl)butanoic acid Openeye Name: 4-amino-3-(5-methoxybenzofuran-2-yl)butanoic acid CAS Name: 4-amino-3-(5-methoxy-2-benzofuranyl)butanoic acid IUPAC Name: 4-amino-3-(5-methoxy-1-benzofuran-2-yl)butanoic acid Traditional Name: 4-amino-3-(5-methoxybenzofuran-2-yl)butyric acid Formula: C13H15NO4 MolecularWeight: 249.2625

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC(=C2)C(CC(=O)O)CN

Isomeric SMILES

COC1=CC2=C(C=C1)OC(=C2)C(CC(=O)O)CN

InChI

InChI=1S/C13H15NO4/c1-17-10-2-3-11-8(4-10)5-12(18-11)9(7-14)6-13(15)16/h2-5,9H,6-7,14H2,1H3,(H,15,16)