3-[5-(1-benzofuran-2-ylcarbonylamino)-1,3-bis(oxidanylidene)isoindol-2-yl]propanoic acid

Systemtic Name: 3-[5-(1-benzofuran-2-ylcarbonylamino)-1,3-bis(oxidanylidene)isoindol-2-yl]propanoic acid Openeye Name: 3-[5-(benzofuran-2-carbonylamino)-1,3-dioxo-isoindolin-2-yl]propanoic acid CAS Name: 3-[5-[[2-benzofuranyl(oxo)methyl]amino]-1,3-dioxo-2-isoindolyl]propanoic acid IUPAC Name: 3-[5-(1-benzofuran-2-carbonylamino)-1,3-dioxoisoindol-2-yl]propanoic acid Traditional Name: 3-[5-(benzofuran-2-carbonylamino)-1,3-diketo-isoindolin-2-yl]propionic acid Formula: C20H14N2O6 MolecularWeight: 378.33496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C(=O)NC3=CC4=C(C=C3)C(=O)N(C4=O)CCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C(=O)NC3=CC4=C(C=C3)C(=O)N(C4=O)CCC(=O)O

InChI

InChI=1S/C20H14N2O6/c23-17(24)7-8-22-19(26)13-6-5-12(10-14(13)20(22)27)21-18(25)16-9-11-3-1-2-4-15(11)28-16/h1-6,9-10H,7-8H2,(H,21,25)(H,23,24)