4-oxidanylidene-4-[(3-oxidanylidene-1H-2-benzofuran-5-yl)amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[(3-oxidanylidene-1H-2-benzofuran-5-yl)amino]butanoic acid Openeye Name: 4-oxo-4-[(3-oxo-1H-isobenzofuran-5-yl)amino]butanoic acid CAS Name: 4-oxo-4-[(3-oxo-1H-isobenzofuran-5-yl)amino]butanoic acid IUPAC Name: 4-oxo-4-[(3-oxo-1H-2-benzofuran-5-yl)amino]butanoic acid Traditional Name: 4-keto-4-[(3-ketophthalan-5-yl)amino]butyric acid Formula: C12H11NO5 MolecularWeight: 249.21944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)NC(=O)CCC(=O)O)C(=O)O1

Isomeric SMILES

C1C2=C(C=C(C=C2)NC(=O)CCC(=O)O)C(=O)O1

InChI

InChI=1S/C12H11NO5/c14-10(3-4-11(15)16)13-8-2-1-7-6-18-12(17)9(7)5-8/h1-2,5H,3-4,6H2,(H,13,14)(H,15,16)